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4-(3-Chloroanilino)benzoic acid
The title compound, C(13)H(10)ClNO(2), was synthesized by a Buchwald–Hartwig reaction and its crystal structure was investigated for the first time. Crystallization in a variety of solvents led to the discovery of one crystal form. High-quality single crystals were obtained by slow evaporation and t...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2023
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10626612/ https://www.ncbi.nlm.nih.gov/pubmed/37937123 http://dx.doi.org/10.1107/S2414314623005989 |
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author | Liu, Xiaoting Long, Sihui |
author_facet | Liu, Xiaoting Long, Sihui |
author_sort | Liu, Xiaoting |
collection | PubMed |
description | The title compound, C(13)H(10)ClNO(2), was synthesized by a Buchwald–Hartwig reaction and its crystal structure was investigated for the first time. Crystallization in a variety of solvents led to the discovery of one crystal form. High-quality single crystals were obtained by slow evaporation and the crystal structure was determined by single-crystal X-ray diffraction. The molecules in the crystal structures are highly twisted [the dihedral angle between the aromatic rings is 34.66 (6)°] and pair up to form acid–acid dimers. [Image: see text] |
format | Online Article Text |
id | pubmed-10626612 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2023 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-106266122023-11-07 4-(3-Chloroanilino)benzoic acid Liu, Xiaoting Long, Sihui IUCrdata Data Reports The title compound, C(13)H(10)ClNO(2), was synthesized by a Buchwald–Hartwig reaction and its crystal structure was investigated for the first time. Crystallization in a variety of solvents led to the discovery of one crystal form. High-quality single crystals were obtained by slow evaporation and the crystal structure was determined by single-crystal X-ray diffraction. The molecules in the crystal structures are highly twisted [the dihedral angle between the aromatic rings is 34.66 (6)°] and pair up to form acid–acid dimers. [Image: see text] International Union of Crystallography 2023-07-14 /pmc/articles/PMC10626612/ /pubmed/37937123 http://dx.doi.org/10.1107/S2414314623005989 Text en © Liu and Long 2023 https://creativecommons.org/licenses/by/4.0/This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited. |
spellingShingle | Data Reports Liu, Xiaoting Long, Sihui 4-(3-Chloroanilino)benzoic acid |
title | 4-(3-Chloroanilino)benzoic acid |
title_full | 4-(3-Chloroanilino)benzoic acid |
title_fullStr | 4-(3-Chloroanilino)benzoic acid |
title_full_unstemmed | 4-(3-Chloroanilino)benzoic acid |
title_short | 4-(3-Chloroanilino)benzoic acid |
title_sort | 4-(3-chloroanilino)benzoic acid |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10626612/ https://www.ncbi.nlm.nih.gov/pubmed/37937123 http://dx.doi.org/10.1107/S2414314623005989 |
work_keys_str_mv | AT liuxiaoting 43chloroanilinobenzoicacid AT longsihui 43chloroanilinobenzoicacid |