Pub Date : 2024-11-01DOI: 10.1107/S2414314624011210
Lubabalo Ndima , Eric Cyriel Hosten , Richard Betz
The central atom of the complex anion is coordinated by one triphenylphosphane and three chlorido ligands. The negative charge is balanced by a triphenylphosphonium cation. Two benzene solvent molecules are also present in the asymmetric unit.
The solvated title compound, (C18H16P)[CoCl3(C18H15P)]·2C6H6, is the triphenylphosphonium salt of an anionic CoII chlorido coordination compound; the asymmetric unit features an ion-pair and two benzene solvent molecules. One of the solvent molecules shows rotational disorder. C—H⋯Cl and P—H⋯Cl contacts connect the individual constituents into infinite chains extending parallel to [010].
{"title":"Triphenylphosphonium trichlorido(triphenylphosphane-κP)cobaltate(II) benzene disolvate","authors":"Lubabalo Ndima , Eric Cyriel Hosten , Richard Betz","doi":"10.1107/S2414314624011210","DOIUrl":"10.1107/S2414314624011210","url":null,"abstract":"<div><div>The central atom of the complex anion is coordinated by one triphenylphosphane and three chlorido ligands. The negative charge is balanced by a triphenylphosphonium cation. Two benzene solvent molecules are also present in the asymmetric unit.</div></div><div><div>The solvated title compound, (C<sub>18</sub>H<sub>16</sub>P)[CoCl<sub>3</sub>(C<sub>18</sub>H<sub>15</sub>P)]·2C<sub>6</sub>H<sub>6</sub>, is the triphenylphosphonium salt of an anionic Co<sup>II</sup> chlorido coordination compound; the asymmetric unit features an ion-pair and two benzene solvent molecules. One of the solvent molecules shows rotational disorder. C—H⋯Cl and P—H⋯Cl contacts connect the individual constituents into infinite chains extending parallel to [010].<span><figure><span><img><ol><li><span><span>Download: <span>Download high-res image (406KB)</span></span></span></li><li><span><span>Download: <span>Download full-size image</span></span></span></li></ol></span></figure></span></div></div>","PeriodicalId":94324,"journal":{"name":"IUCrData","volume":"9 11","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-11-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11618865/pdf/","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142796769","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-11-01DOI: 10.1107/S241431462401126X
Tashonda M. Vaughn , Saneei Soheil , Olalekan M. Ogundele , Frank R. Fronczek , Rao M. Uppu
The title compound is almost planar. In the crystal, the molecules form centrosymmetric hydrogen-bonded dimers through pairwise O—H⋯N interactions to generate R22(8) loops.
The title compound, C5H2Cl3NO, is almost planar. In the crystal, the molecules form centrosymmetric hydrogen-bonded dimers through pairwise O—H⋯N interactions to generate R22(8) loops.
{"title":"3,5,6-Trichloropyridin-2-ol","authors":"Tashonda M. Vaughn , Saneei Soheil , Olalekan M. Ogundele , Frank R. Fronczek , Rao M. Uppu","doi":"10.1107/S241431462401126X","DOIUrl":"10.1107/S241431462401126X","url":null,"abstract":"<div><div>The title compound is almost planar. In the crystal, the molecules form centrosymmetric hydrogen-bonded dimers through pairwise O—H⋯N interactions to generate <em>R</em><sup>2</sup><sub>2</sub>(8) loops.</div></div><div><div>The title compound, C<sub>5</sub>H<sub>2</sub>Cl<sub>3</sub>NO, is almost planar. In the crystal, the molecules form centrosymmetric hydrogen-bonded dimers through pairwise O—H⋯N interactions to generate <em>R</em><sup>2</sup><sub>2</sub>(8) loops.<span><figure><span><img><ol><li><span><span>Download: <span>Download high-res image (298KB)</span></span></span></li><li><span><span>Download: <span>Download full-size image</span></span></span></li></ol></span></figure></span></div></div>","PeriodicalId":94324,"journal":{"name":"IUCrData","volume":"9 11","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-11-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11618871/pdf/","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142796762","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-11-01DOI: 10.1107/S2414314624010617
Joshua Birch , Eric Cyriel Hosten , Richard Betz
In the title compound, the symmetric phosphate derived from para-chlorophenol and phosphoric acid, two of the three aromatic moieties adopt syn-orientation towards the P=O bond while the last chlorophenol ring is pointing away from this bond. In the extended structure, C—H⋯O bonds connect the individual molecules into sheets lying perpendicular to the crystallographic b axis.
The title compound, C18H12Cl3O4P, is the symmetric phosphate derived from para-chlorophenol and phosphoric acid. Two of the three aromatic moieties adopt syn-orientation towards the P=O bond while the last chlorophenol ring is pointing away from this bond. In the extended structure, C—H⋯O bonds connect the individual molecules into sheets lying perpendicular to the crystallographic b axis.
{"title":"Tris(4-chlorophenyl) phosphate","authors":"Joshua Birch , Eric Cyriel Hosten , Richard Betz","doi":"10.1107/S2414314624010617","DOIUrl":"10.1107/S2414314624010617","url":null,"abstract":"<div><div>In the title compound, the symmetric phosphate derived from <em>para</em>-chlorophenol and phosphoric acid, two of the three aromatic moieties adopt <em>syn</em>-orientation towards the P=O bond while the last chlorophenol ring is pointing away from this bond. In the extended structure, C—H⋯O bonds connect the individual molecules into sheets lying perpendicular to the crystallographic <em>b</em> axis.</div></div><div><div>The title compound, C<sub>18</sub>H<sub>12</sub>Cl<sub>3</sub>O<sub>4</sub>P, is the symmetric phosphate derived from <em>para</em>-chlorophenol and phosphoric acid. Two of the three aromatic moieties adopt <em>syn</em>-orientation towards the P=O bond while the last chlorophenol ring is pointing away from this bond. In the extended structure, C—H⋯O bonds connect the individual molecules into sheets lying perpendicular to the crystallographic <em>b</em> axis.<span><figure><span><img><ol><li><span><span>Download: <span>Download high-res image (197KB)</span></span></span></li><li><span><span>Download: <span>Download full-size image</span></span></span></li></ol></span></figure></span></div></div>","PeriodicalId":94324,"journal":{"name":"IUCrData","volume":"9 11","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-11-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11618868/pdf/","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142796770","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-10-01DOI: 10.1107/S2414314624009684
Arindam Saha , Daniel Chartrand , Mihaela Cibian , Thierry Maris , Garry S. Hanan
Bright-yellow single crystals of the title compound were synthesized as part of a project that explores the formation of earth-abundant transition-metal complexes of amidine oxides (AMOXs), to study their photophysical and redox properties. The HNCNO moiety of the compound shows double-bond delocalization over the N—C—N part, evident from the similar C—N bond distances.
The title compound, C19H15BrN2O, crystallizes with two similar molecules in the asymmetric unit. The extended structure features dimers linked by pairs of N—H⋯O and C—H⋯O hydrogen bonds. The HNCNO moiety of the title compound shows delocalization over the N—C—N part, as evidenced by the similar C—N bond distances.
{"title":"4-Bromo-N,N′-diphenylbenzimidamide N′-oxide","authors":"Arindam Saha , Daniel Chartrand , Mihaela Cibian , Thierry Maris , Garry S. Hanan","doi":"10.1107/S2414314624009684","DOIUrl":"10.1107/S2414314624009684","url":null,"abstract":"<div><div>Bright-yellow single crystals of the title compound were synthesized as part of a project that explores the formation of earth-abundant transition-metal complexes of amidine oxides (AMOXs), to study their photophysical and redox properties. The HNCNO moiety of the compound shows double-bond delocalization over the N—C—N part, evident from the similar C—N bond distances.</div></div><div><div>The title compound, C<sub>19</sub>H<sub>15</sub>BrN<sub>2</sub>O, crystallizes with two similar molecules in the asymmetric unit. The extended structure features dimers linked by pairs of N—H⋯O and C—H⋯O hydrogen bonds. The HNCNO moiety of the title compound shows delocalization over the N—C—N part, as evidenced by the similar C—N bond distances.<span><figure><span><img><ol><li><span><span>Download: <span>Download high-res image (268KB)</span></span></span></li><li><span><span>Download: <span>Download full-size image</span></span></span></li></ol></span></figure></span></div></div>","PeriodicalId":94324,"journal":{"name":"IUCrData","volume":"9 10","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-10-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11660173/pdf/","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142879200","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-10-01DOI: 10.1107/S2414314624009672
Mohd Abdul Fatah Abdul Manan , David B. Cordes , Aidan P. McKay
The crystal structure of a new S-methyl substituted dithiocarbazate imine containing the 5-methylisatin moiety is described.
The title dithiocarbazate imine, C11H11N3OS2, was obtained from the condensation reaction of S-methyldithiocarbazate (SMDTC) and 5-methylisatin. It shows a Z configuration about the imine C=N bond, which is associated with an intramolecular N—H⋯O hydrogen bond that closes an S(6) ring. In the crystal, inversion dimers linked by pairwise N—H⋯O hydrogen bonds generate R22(8) loops. The extended structure features C—H⋯S contacts as well as reciprocal carbonyl–carbonyl (C=O⋯C=O) interactions.
{"title":"Methyl 2-[(Z)-5-methyl-2-oxoindolin-3-ylidene]hydrazinecarbodithioate","authors":"Mohd Abdul Fatah Abdul Manan , David B. Cordes , Aidan P. McKay","doi":"10.1107/S2414314624009672","DOIUrl":"10.1107/S2414314624009672","url":null,"abstract":"<div><div>The crystal structure of a new <em>S</em>-methyl substituted dithiocarbazate imine containing the 5-methylisatin moiety is described.</div></div><div><div>The title dithiocarbazate imine, C<sub>11</sub>H<sub>11</sub>N<sub>3</sub>OS<sub>2</sub>, was obtained from the condensation reaction of <em>S</em>-methyldithiocarbazate (SMDTC) and 5-methylisatin. It shows a <em>Z</em> configuration about the imine C=N bond, which is associated with an intramolecular N—H⋯O hydrogen bond that closes an <em>S</em>(6) ring. In the crystal, inversion dimers linked by pairwise N—H⋯O hydrogen bonds generate <em>R</em><sup>2</sup><sub>2</sub>(8) loops. The extended structure features C—H⋯S contacts as well as reciprocal carbonyl–carbonyl (C=O⋯C=O) interactions.<span><figure><span><img><ol><li><span><span>Download: <span>Download high-res image (211KB)</span></span></span></li><li><span><span>Download: <span>Download full-size image</span></span></span></li></ol></span></figure></span></div></div>","PeriodicalId":94324,"journal":{"name":"IUCrData","volume":"9 10","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-10-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11660172/pdf/","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142879278","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-10-01DOI: 10.1107/S241431462400988X
David O. Juma , Bernard Omondi , Sizwe J. Zamisa , Wisdom Munzeiwa
The crystal structure of a zwitterionic, non-symmetric hydroxyformamidine derivative is described.
The molecular structure of the title compound, C20H26N2O2 reveals non-co-planarity between the central formamidine backbone and each of the outer methoxy- and i-propyl- substituted benzene rings with dihedral angles of 7.88 (15) and 81.17 (15)°, respectively, indicating significant twists in the molecule. In the crystal, intermolecular C—H⋯O interactions, forming an R34(30) graph set, occur within a two-dimensional layer that extends along the ac plane.
{"title":"(Z)-N-(2,6-Diisopropylphenyl)-1-[(2-methoxyphenyl)amino]methanimine oxide","authors":"David O. Juma , Bernard Omondi , Sizwe J. Zamisa , Wisdom Munzeiwa","doi":"10.1107/S241431462400988X","DOIUrl":"10.1107/S241431462400988X","url":null,"abstract":"<div><div>The crystal structure of a zwitterionic, non-symmetric hydroxyformamidine derivative is described.</div></div><div><div>The molecular structure of the title compound, C<sub>20</sub>H<sub>26</sub>N<sub>2</sub>O<sub>2</sub> reveals non-co-planarity between the central formamidine backbone and each of the outer methoxy- and <em>i</em>-propyl- substituted benzene rings with dihedral angles of 7.88 (15) and 81.17 (15)°, respectively, indicating significant twists in the molecule. In the crystal, intermolecular C—H⋯O interactions, forming an <em>R</em><sup>3</sup><sub>4</sub>(30) graph set, occur within a two-dimensional layer that extends along the <em>ac</em> plane.<span><figure><span><img><ol><li><span><span>Download: <span>Download high-res image (246KB)</span></span></span></li><li><span><span>Download: <span>Download full-size image</span></span></span></li></ol></span></figure></span></div></div>","PeriodicalId":94324,"journal":{"name":"IUCrData","volume":"9 10","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-10-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11660170/pdf/","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142879236","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-10-01DOI: 10.1107/S2414314624010393
Petrus Prinsloo , Eric Cyriel Hosten , Richard Betz
The asymmetric unit contains two complete molecules. Classical hydrogen bonds, as well as C—H⋯O contacts, connect the molecules to infinite chains along the c-axis direction.
The title compound, C14H12O3, is an α-hydroxycarboxylic acid whose orthorhombic polymorph has been reported earlier [Qiu et al. (2007#). Inorg. Chim. Acta, 360, 1819–1824]. The asymmetric unit contains two complete molecules. Classical hydrogen bonds, as well as C—H⋯O contacts, connect the molecules to infinite chains along the crystallographic c-axis direction.
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标题化合物C14H12O3是一种α-羟基碳氧酸，其邻菱形多晶结构早有报道[Qiu et al.（2007▸）]。Inorg。詹。学报，360,1819 -1824]。不对称单元包含两个完整的分子。经典氢键，以及C-H⋯O接触，沿着结晶学的c轴方向将分子连接到无限链上。
{"title":"Benzilic acid: a monoclinic polymorph","authors":"Petrus Prinsloo , Eric Cyriel Hosten , Richard Betz","doi":"10.1107/S2414314624010393","DOIUrl":"10.1107/S2414314624010393","url":null,"abstract":"<div><div>The asymmetric unit contains two complete molecules. Classical hydrogen bonds, as well as C—H⋯O contacts, connect the molecules to infinite chains along the <em>c</em>-axis direction.</div></div><div><div>The title compound, C<sub>14</sub>H<sub>12</sub>O<sub>3</sub>, is an α-hydroxycarboxylic acid whose orthorhombic polymorph has been reported earlier [Qiu <em>et al.</em> (2007<span><span>#</span></span>). <em>Inorg. Chim. Acta</em>, <strong>360</strong>, 1819–1824]. The asymmetric unit contains two complete molecules. Classical hydrogen bonds, as well as C—H⋯O contacts, connect the molecules to infinite chains along the crystallographic <em>c-</em>axis direction.<span><figure><span><img><ol><li><span><span>Download: <span>Download high-res image (260KB)</span></span></span></li><li><span><span>Download: <span>Download full-size image</span></span></span></li></ol></span></figure></span></div></div>","PeriodicalId":94324,"journal":{"name":"IUCrData","volume":"9 10","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-10-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11660171/pdf/","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142879271","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-10-01DOI: 10.1107/S241431462401006X
Themmila Khamrang , A. Kannan , Madhukar Hemamalini , Muhammad Nawaz Tahir , G. Jerald Maria Antony , Dhandayutham Saravanan
In the crystal of the title compound, the molecules are linked by N—H⋯N hydrogen bonds, generating a C(4) chain extending along the c-axis direction.
In the crystal of the title compound, C12H17N3, the molecules are linked by N—H⋯N hydrogen bonds, generating a C(4) chain extending along the c-axis direction. One of the ethyl groups is disordered over two sets of sites with a refined occupancy ratio of 0.582 (15):0.418 (15).
{"title":"(1H-Benzodiazol-2-ylmethyl)diethylamine","authors":"Themmila Khamrang , A. Kannan , Madhukar Hemamalini , Muhammad Nawaz Tahir , G. Jerald Maria Antony , Dhandayutham Saravanan","doi":"10.1107/S241431462401006X","DOIUrl":"10.1107/S241431462401006X","url":null,"abstract":"<div><div>In the crystal of the title compound, the molecules are linked by N—H⋯N hydrogen bonds, generating a <em>C</em>(4) chain extending along the <em>c</em>-axis direction.</div></div><div><div>In the crystal of the title compound, C<sub>12</sub>H<sub>17</sub>N<sub>3</sub>, the molecules are linked by N—H⋯N hydrogen bonds, generating a <em>C</em>(4) chain extending along the <em>c</em>-axis direction. One of the ethyl groups is disordered over two sets of sites with a refined occupancy ratio of 0.582 (15):0.418 (15).<span><figure><span><img><ol><li><span><span>Download: <span>Download high-res image (182KB)</span></span></span></li><li><span><span>Download: <span>Download full-size image</span></span></span></li></ol></span></figure></span></div></div>","PeriodicalId":94324,"journal":{"name":"IUCrData","volume":"9 10","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-10-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11660169/pdf/","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142879245","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-10-01DOI: 10.1107/S2414314624010320
Dieter Schollmeyer , Igor Proz , Heiner Detert
The title compound was prepared as a racemate of R,R- and S,S-enantiomers by reduction of the corresponding hydroxyiminoketone. In the crystal, layers are formed via hydrogen bridges of four ammonium groups to chloride ions; these lamellae are connected via interdigitated benzoic ester groups.
The title compound, C14H20NO5+·Cl−, was prepared as a racemate of R,R- and S,S-enantiomers by reduction of the corresponding hydroxyiminoketone. In the crystal, layers are formed via hydrogen bridges of four ammonium groups to chloride ions; these lamellae are connected via interdigitated benzoic ester groups.
{"title":"1-Ethoxy-3-[4-(ethoxycarbonyl)phenyl]-3-hydroxy-1-oxopropan-2-aminium chloride","authors":"Dieter Schollmeyer , Igor Proz , Heiner Detert","doi":"10.1107/S2414314624010320","DOIUrl":"10.1107/S2414314624010320","url":null,"abstract":"<div><div>The title compound was prepared as a racemate of <em>R</em>,<em>R</em>- and <em>S</em>,<em>S</em>-enantiomers by reduction of the corresponding hydroxyiminoketone. In the crystal, layers are formed <em>via</em> hydrogen bridges of four ammonium groups to chloride ions; these lamellae are connected <em>via</em> interdigitated benzoic ester groups.</div></div><div><div>The title compound, C<sub>14</sub>H<sub>20</sub>NO<sub>5</sub><sup>+</sup>·Cl<sup>−</sup>, was prepared as a racemate of <em>R</em>,<em>R</em>- and <em>S</em>,<em>S</em>-enantiomers by reduction of the corresponding hydroxyiminoketone. In the crystal, layers are formed <em>via</em> hydrogen bridges of four ammonium groups to chloride ions; these lamellae are connected <em>via</em> interdigitated benzoic ester groups.<span><figure><span><img><ol><li><span><span>Download: <span>Download high-res image (223KB)</span></span></span></li><li><span><span>Download: <span>Download full-size image</span></span></span></li></ol></span></figure></span></div></div>","PeriodicalId":94324,"journal":{"name":"IUCrData","volume":"9 10","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-10-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11660177/pdf/","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142879268","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-10-01DOI: 10.1107/S2414314624010150
Abderrazzak El Moutaouakil Ala Allah , Benson M. Kariuki , Issam Ameziane El Hassani , Abdulsalam Alsubari , Walid Guerrab , Musa A. Said , Youssef Ramli
The title compound is significantly distorted from planarity, with a twist angle between the planes through the hydroxybenzene and acetamide groups being 23.5 (2)°. This conformation is supported by intramolecular C—H⋯O and N—H⋯Cl contacts. In the crystal, N—H⋯O hydrogen-bonding contacts between acetamide groups and O—H⋯O contacts between hydroxyl groups form tapes propagating parallel to [103].
The title compound, C8H8ClNO2, is significantly distorted from planarity, with a twist angle between the planes through the hydroxybenzene and acetamide groups being 23.5 (2)°. This conformation is supported by intramolecular C—H⋯O and N—H⋯Cl contacts. In the crystal, N—H⋯O hydrogen-bonding contacts between acetamide groups and O—H⋯O contacts between hydroxyl groups form tapes propagating parallel to [103].
{"title":"2-Chloro-N-(4-hydroxyphenyl)acetamide","authors":"Abderrazzak El Moutaouakil Ala Allah , Benson M. Kariuki , Issam Ameziane El Hassani , Abdulsalam Alsubari , Walid Guerrab , Musa A. Said , Youssef Ramli","doi":"10.1107/S2414314624010150","DOIUrl":"10.1107/S2414314624010150","url":null,"abstract":"<div><div>The title compound is significantly distorted from planarity, with a twist angle between the planes through the hydroxybenzene and acetamide groups being 23.5 (2)°. This conformation is supported by intramolecular C—H⋯O and N—H⋯Cl contacts. In the crystal, N—H⋯O hydrogen-bonding contacts between acetamide groups and O—H⋯O contacts between hydroxyl groups form tapes propagating parallel to [103].</div></div><div><div>The title compound, C<sub>8</sub>H<sub>8</sub>ClNO<sub>2</sub>, is significantly distorted from planarity, with a twist angle between the planes through the hydroxybenzene and acetamide groups being 23.5 (2)°. This conformation is supported by intramolecular C—H⋯O and N—H⋯Cl contacts. In the crystal, N—H⋯O hydrogen-bonding contacts between acetamide groups and O—H⋯O contacts between hydroxyl groups form tapes propagating parallel to [103].<span><figure><span><img><ol><li><span><span>Download: <span>Download high-res image (201KB)</span></span></span></li><li><span><span>Download: <span>Download full-size image</span></span></span></li></ol></span></figure></span></div></div>","PeriodicalId":94324,"journal":{"name":"IUCrData","volume":"9 10","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-10-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11660168/pdf/","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142879270","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
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