{"title":"3-Iodo-aniline。","authors":"Ferhan Slamang, Eric Cyriel Hosten, Richard Betz","doi":"10.1107/S2414314624012264","DOIUrl":null,"url":null,"abstract":"<p><p>The title compound, C<sub>6</sub>H<sub>6</sub>IN, is the <i>meta</i>-iodinated derivative of aniline. The asymmetric unit contains two mol-ecules. The structure was refined as a two-component inversion twin with a volume ratio of 55.6:44.4. In the crystal, cooperative hydrogen bonds of the N-H⋯N type connect the mol-ecules into infinite chains propagating along the <i>a-</i>axis direction. Dispersive I⋯I contacts extend these chains to sheets perpendicular to the crystallographic <i>c</i> axis.</p>","PeriodicalId":94324,"journal":{"name":"IUCrData","volume":"9 Pt 12","pages":"x241226"},"PeriodicalIF":0.0000,"publicationDate":"2024-12-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11701754/pdf/","citationCount":"0","resultStr":"{\"title\":\"3-Iodo-aniline.\",\"authors\":\"Ferhan Slamang, Eric Cyriel Hosten, Richard Betz\",\"doi\":\"10.1107/S2414314624012264\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<p><p>The title compound, C<sub>6</sub>H<sub>6</sub>IN, is the <i>meta</i>-iodinated derivative of aniline. The asymmetric unit contains two mol-ecules. The structure was refined as a two-component inversion twin with a volume ratio of 55.6:44.4. In the crystal, cooperative hydrogen bonds of the N-H⋯N type connect the mol-ecules into infinite chains propagating along the <i>a-</i>axis direction. Dispersive I⋯I contacts extend these chains to sheets perpendicular to the crystallographic <i>c</i> axis.</p>\",\"PeriodicalId\":94324,\"journal\":{\"name\":\"IUCrData\",\"volume\":\"9 Pt 12\",\"pages\":\"x241226\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2024-12-24\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11701754/pdf/\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"IUCrData\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.1107/S2414314624012264\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"2024/12/1 0:00:00\",\"PubModel\":\"eCollection\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"IUCrData","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.1107/S2414314624012264","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"2024/12/1 0:00:00","PubModel":"eCollection","JCR":"","JCRName":"","Score":null,"Total":0}
The title compound, C6H6IN, is the meta-iodinated derivative of aniline. The asymmetric unit contains two mol-ecules. The structure was refined as a two-component inversion twin with a volume ratio of 55.6:44.4. In the crystal, cooperative hydrogen bonds of the N-H⋯N type connect the mol-ecules into infinite chains propagating along the a-axis direction. Dispersive I⋯I contacts extend these chains to sheets perpendicular to the crystallographic c axis.
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