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Crystal structure of dimethyl (R)-2-(3-(1-phenylethyl)thioureido)-[1,1′-biphenyl]-4,4′-dicarboxylate, C25H24N2O4S (R)-2-(3-(1-苯基乙基)硫脲基)-[1,1′-联苯]-4,4′-二甲酸二甲酯 C25H24N2O4S 的晶体结构
Zeitschrift für Kristallographie - New Crystal Structures
Pub Date : 2024-04-09 DOI: 10.1515/ncrs-2024-0099
Yi Chen, D. Shi
C25H24N2O4S, orthorhombic, P212121 (no. 19), a = 6.8049(5) Å, b = 12.2546(8) Å, c = 26.8916(18) Å, V = 2242.5(3) Å3, Z = 4, R gt(F) = 0.0581, wR ref(F 2) = 0.1560, T = 100 K.
C25H24N2O4S，正交，P212121（编号 19），a = 6.8049(5)埃，b = 12.2546(8)埃，c = 26.8916(18)埃，V = 2242.5(3) 埃3，Z = 4，R gt(F) = 0.0581，wR ref(F 2) = 0.1560，T = 100 K。
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引用次数: 0
Crystal structure of N-(acridin-9-yl)-2-(4-methylpiperidin-1-yl) acetamide monohydrate, C21H25N3O2 N-(吖啶-9-基)-2-(4-甲基哌啶-1-基)乙酰胺一水合物 C21H25N3O2 的晶体结构
Zeitschrift für Kristallographie - New Crystal Structures
Pub Date : 2024-04-05 DOI: 10.1515/ncrs-2024-0050
Chen Yang Jing, Dan Zhou, Yu Qian Kan, Pei Rong Zhao, Wen Li
C21H25N3O2, triclinic, P1̄ (no. 2), a = 7.6536(6) Å, b = 11.027(1) Å, c = 12.6899(11) Å, α = 66.863(2)°, β = 80.598(2)°, γ = 71.772(2)°, V = 934.38(14) Å3, Z = 2, R gt(F) = 0.0679, wR ref(F 2) = 0.1150, T = 296 K.
C21H25N3O2, 三菱形, P1̄ (no. 2), a = 7.6536(6) Å, b = 11.027(1) Å, c = 12.6899(11) Å, α = 66.863(2)°, β = 80.598(2)°, γ = 71.772(2)°, V = 934.38(14) Å3, Z = 2, R gt(F) = 0.0679, wR ref(F 2) = 0.1150, T = 296 K.
{"title":"Crystal structure of N-(acridin-9-yl)-2-(4-methylpiperidin-1-yl) acetamide monohydrate, C21H25N3O2","authors":"Chen Yang Jing, Dan Zhou, Yu Qian Kan, Pei Rong Zhao, Wen Li","doi":"10.1515/ncrs-2024-0050","DOIUrl":"https://doi.org/10.1515/ncrs-2024-0050","url":null,"abstract":"\u0000 C21H25N3O2, triclinic, P1̄ (no. 2), a = 7.6536(6) Å, b = 11.027(1) Å, c = 12.6899(11) Å, α = 66.863(2)°, β = 80.598(2)°, γ = 71.772(2)°, V = 934.38(14) Å3, Z = 2, R\u0000 gt(F) = 0.0679, wR\u0000 ref(F\u0000 2) = 0.1150, T = 296 K.","PeriodicalId":23885,"journal":{"name":"Zeitschrift für Kristallographie - New Crystal Structures","volume":"39 24","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-04-05","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"140737465","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 1
Crystal structure of N-(1-(3,4-dimethoxyphenyl)-2-methylpropyl)aniline, C18H23NO2 N-(1-(3,4-二甲氧基苯基)-2-甲基丙基)苯胺（C18H23NO2）的晶体结构
Zeitschrift für Kristallographie - New Crystal Structures
Pub Date : 2024-04-05 DOI: 10.1515/ncrs-2024-0079
Qian Zhu, Zhen Yao
C18H23NO2, monoclinic, C2/c (no. 15), a = 23.188(2) Å, b = 7.9820(5) Å, c = 20.6004(15) Å, β = 119.696(7)°, V = 3312.1(5) Å3, Z = 8, Rgt (F) = 0.0923, wRref (F 2) = 0.1920, T = 293 K.
C18H23NO2，单斜，C2/c（编号 15），a = 23.188(2)埃，b = 7.9820(5)埃，c = 20.6004(15)埃，β = 119.696(7)°，V = 3312.1(5)埃3，Z = 8，Rgt (F) = 0.0923，wRref (F 2) = 0.1920，T = 293 K。
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引用次数: 0
Crystal structure of 4-amino-3,5-dibromobenzonitrile, C7H4Br2N2 4-氨基-3,5-二溴苯腈（C7H4Br2N2）的晶体结构
Zeitschrift für Kristallographie - New Crystal Structures
Pub Date : 2024-04-05 DOI: 10.1515/ncrs-2024-0068
Jinke Jiang, Hui Jiang
C7H4Br2N2, monoclinic, C2/c (no. 15), a = 42.364(10) Å, b = 3.9052(4) Å, c = 23.783(3) Å, β = 120.984(9)°, V = 3373.2(10) Å3, Z = 16, Rgt (F) = 0.0415, wRref (F 2) = 0.1073, T = 298 K.
C7H4Br2N2，单斜，C2/c（编号 15），a = 42.364(10)埃，b = 3.9052(4)埃，c = 23.783(3)埃，β = 120.984(9)°，V = 3373.2(10)埃3，Z = 16，Rgt (F) = 0.0415，wRref (F 2) = 0.1073，T = 298 K。
{"title":"Crystal structure of 4-amino-3,5-dibromobenzonitrile, C7H4Br2N2","authors":"Jinke Jiang, Hui Jiang","doi":"10.1515/ncrs-2024-0068","DOIUrl":"https://doi.org/10.1515/ncrs-2024-0068","url":null,"abstract":"\u0000 C7H4Br2N2, monoclinic, C2/c (no. 15), a = 42.364(10) Å, b = 3.9052(4) Å, c = 23.783(3) Å, β = 120.984(9)°, V = 3373.2(10) Å3, Z = 16, Rgt\u0000 (F) = 0.0415, wRref\u0000 (F\u0000 2) = 0.1073, T = 298 K.","PeriodicalId":23885,"journal":{"name":"Zeitschrift für Kristallographie - New Crystal Structures","volume":"31 6","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-04-05","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"140738336","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
The crystal structure of unsymmetrical BOPHY C26H27BN4 非对称 BOPHY C26H27BN4 的晶体结构
Zeitschrift für Kristallographie - New Crystal Structures
Pub Date : 2024-04-05 DOI: 10.1515/ncrs-2024-0061
G. H. Al-Hazmi, Moamen S. Refat, Rabia Usman, Arshad Khan
C26H27BN4, monoclinic, C2/c (no. 15), a = 38.716(3) Å, b = 9.2723(6) Å, c = 27.3977(18) Å, β = 113.4790(10)°, V = 9021.1(11) Å3, Z = 16, Rgt (F) = 0.0520, wRref (F 2) = 0.1440, T = 100 K.
C26H27BN4，单斜，C2/c（编号 15），a = 38.716(3)埃，b = 9.2723(6)埃，c = 27.3977(18)埃，β = 113.4790(10)°，V = 9021.1(11)埃3，Z = 16，Rgt (F) = 0.0520，wRref (F 2) = 0.1440，T = 100 K。
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引用次数: 0
Synthesis and crystal structure of dimethyl 4,4′-(propane-1,3-diylbis(oxy))dibenzoate, C19H20O6 4,4′-(propane-1,3-diylbis(oxy))dibenzoate, C19H20O6 的合成和晶体结构
Zeitschrift für Kristallographie - New Crystal Structures
Pub Date : 2024-04-05 DOI: 10.1515/ncrs-2024-0102
Miao-Miao Li, Yan-Ling Zheng
[C19H20O6], monoclinic, C2/c (no. 15), a = 22.467(2) Å, b = 4.9925(5) Å, c = 15.8059(17) Å, β = 108.500(1)°, V = 1681.3(3) Å3, Z = 4, R gt(F) = 0.0309, wR ref(F 2) = 0.0852, T = 296(2) K.
[C19H20O6]，单斜，C2/c（编号 15），a = 22.467(2)埃，b = 4.9925(5)埃，c = 15.8059(17)埃，β = 108.500(1)°，V = 1681.3(3)埃3，Z = 4，R gt(F) = 0.0309，wR ref(F 2) = 0.0852，T = 296(2) K。
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引用次数: 0
The structure of RUB-56, (C6H16N)8 [Si32O64(OH)8]·32 H2O, a hydrous layer silicate (2D-zeolite) that contains microporous levyne-type silicate layers RUB-56 的结构，(C6H16N)8 [Si32O64(OH)8]-32 H2O，一种含有微孔鳞片型硅酸盐层的水合层硅酸盐（二维沸石）。
Zeitschrift für Kristallographie - New Crystal Structures
Pub Date : 2024-04-05 DOI: 10.1515/ncrs-2024-0067
Bernd Marler, Antje Gruenewald-Lueke, H. Gies, Trees De Baerdemaeker
C48H200N8O104Si32, monoclinic, C2/m (no. 12), a = 16.2532(14) Å, b = 13.3020(7) Å, c = 16.7771(14) Å, β = 96.476(10)°, V = 3604.07(3) Å3, Z = 1, R(F) = 0.031, χ 2 = 2.44, Rgt (F) = , wRref (F 2) = , T = 293 K.
C48H200N8O104Si32，单斜，C2/m（编号 12），a = 16.2532(14)埃，b = 13.3020(7)埃，c = 16.7771(14)埃，β = 96.476(10)°, V = 3604.07(3) Å3, Z = 1, R(F) = 0.031, χ 2 = 2.44, Rgt (F) = , wRref (F 2) = , T = 293 K。
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引用次数: 0
Crystal structure of Ba6Cd12Mn4SiF48 Ba6Cd12Mn4SiF48 的晶体结构
Zeitschrift für Kristallographie - New Crystal Structures
Pub Date : 2024-04-05 DOI: 10.1515/ncrs-2024-0083
Sun Woo Kim
Ba6Cd12Mn4SiF48, cubic, I m 3 ‾ $Imoverline{3}$ (no. 204), a = 12.57060(10) Å, V = 1986.41(5) Å3, Z = 2, Rgt (F) = 0.0286, wRref (F 2) = 0.0784, T = 296(2) K.
Ba6Cd12Mn4SiF48, cubic, I m 3 ‾ $Imoverline{3}$ (no. 204), a = 12.57060(10) Å, V = 1986.41(5) Å3, Z = 2, Rgt (F) = 0.0286, wRref (F 2) = 0.0784, T = 296(2) K。
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引用次数: 0
Crystal structure of ethyl 2-(3-benzyl-4-oxo-3,4-dihydrophthalazin-1-yl)- 2,2-difluoroacetate, C19H16F2N2O3 2-(3-苄基-4-氧代-3,4-二氢酞嗪-1-基)-2,2-二氟乙酸乙酯（C19H16F2N2O3）的晶体结构
Zeitschrift für Kristallographie - New Crystal Structures
Pub Date : 2024-04-05 DOI: 10.1515/ncrs-2024-0091
Rongrong Huang, Zhen Yao, Ying Zhou
C19H16F2 N 2O3, monoclinic, P21/c (no. 14), a = 17.5688(15) Å, b = 13.8304(11) Å, c = 7.0600(7) Å, β = 100.254(3)∘, V = 1688.1(3) Å3, Z = 4, R gt (F) = 0.0516, wR ref (F2) = 0.1424, T = 200(2) K.
C19H16F2 N 2O3，单斜，P21/c（编号 14），a = 17.5688(15)埃，b = 13.8304(11)埃，c = 7.0600(7)埃，β = 100.254(3)∘，V = 1688.1(3)埃3，Z = 4，R gt (F) = 0.0516，wR ref (F2) = 0.1424，T = 200(2) K。
{"title":"Crystal structure of ethyl 2-(3-benzyl-4-oxo-3,4-dihydrophthalazin-1-yl)- 2,2-difluoroacetate, C19H16F2N2O3","authors":"Rongrong Huang, Zhen Yao, Ying Zhou","doi":"10.1515/ncrs-2024-0091","DOIUrl":"https://doi.org/10.1515/ncrs-2024-0091","url":null,"abstract":"\u0000 C19H16F2\u0000 N\u0000 2O3, monoclinic, P21/c (no. 14), a = 17.5688(15) Å, b = 13.8304(11) Å, c = 7.0600(7) Å, β = 100.254(3)∘, V = 1688.1(3) Å3, Z = 4, R\u0000 \u0000 gt\u0000 (F) = 0.0516, wR\u0000 \u0000 ref\u0000 (F2) = 0.1424, T = 200(2) K.","PeriodicalId":23885,"journal":{"name":"Zeitschrift für Kristallographie - New Crystal Structures","volume":"19 5","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-04-05","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"140737393","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Synthesis and crystal structure of 5-fluoro-1-methyl-2-oxo-3-(2-oxochroman-4-yl)indolin-3-yl acetate, C20H16FNO5 5-氟-1-甲基-2-氧代-3-(2-氧代苯并二氢吡喃-4-基)吲哚啉-3-基乙酸酯（C20H16FNO5）的合成及晶体结构
Zeitschrift für Kristallographie - New Crystal Structures
Pub Date : 2024-04-04 DOI: 10.1515/ncrs-2024-0086
Xiao-Li Feng, Chuanwen Lei, Ying Zhou, Yan-Li Zhang, Xiang-Jun Mao
C20H16FNO5, monoclinic, P21/c (no. 14), a = 9.5235(2) Å, b = 22.1323(2) Å, c = 8.95249(19) Å, β = 101.445(3)°, V = 1779.66(7) Å3, Z = 4, R gt (F) = 0.0410, wR ref (F 2) = 0.1194, T = 279.5 K.
C20H16FNO5，单斜，P21/c（编号 14），a = 9.5235(2)埃，b = 22.1323(2)埃，c = 8.95249(19)埃，β = 101.445(3)°，V = 1779.66(7)埃3，Z = 4，R gt (F) = 0.0410，wR ref (F 2) = 0.1194，T = 279.5 K。
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