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Crystal structure of phenyl N-(3,5-di­methyl­phenyl)carbamate

The asymmetric unit of the title compound, C(15)H(15)NO(2), contains two independent mol­ecules (A and B). The di­methyl­phenyl ring, the phenyl ring and the central carbamate N—C(=O)—O group are not coplanar. In mol­ecule A, the di­methyl­phenyl and phenyl rings are inclined to the carbamate group...

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Autores principales: AaminaNaaz, Y., Sathiyaraj, Subramaniyan, Kalaimani, Sundararaj, Nasar, A. Sultan, SubbiahPandi, A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2017
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5458307/
https://www.ncbi.nlm.nih.gov/pubmed/28638642
http://dx.doi.org/10.1107/S2056989017006922
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author AaminaNaaz, Y.
Sathiyaraj, Subramaniyan
Kalaimani, Sundararaj
Nasar, A. Sultan
SubbiahPandi, A.
author_facet AaminaNaaz, Y.
Sathiyaraj, Subramaniyan
Kalaimani, Sundararaj
Nasar, A. Sultan
SubbiahPandi, A.
author_sort AaminaNaaz, Y.
collection PubMed
description The asymmetric unit of the title compound, C(15)H(15)NO(2), contains two independent mol­ecules (A and B). The di­methyl­phenyl ring, the phenyl ring and the central carbamate N—C(=O)—O group are not coplanar. In mol­ecule A, the di­methyl­phenyl and phenyl rings are inclined to the carbamate group mean plane by 27.71 (13) and 71.70 (4)°, respectively, and to one another by 84.53 (13)°. The corresponding dihedral angles in mol­ecule B are 34.33 (11), 66.32 (13) and 85.48 (12)°, respectively. In the crystal, the A and B mol­ecules are arranged alternately linked through N—H⋯O(carbon­yl) hydrogen bonds, forming –A–B–A–B– chains, which extend along [100]. Within the chains and linking neighbouring chains there are C—H⋯π inter­actions present, forming columns along the a-axis direction. The columns are linked by offset π–π stacking inter­actions, forming a three-dimensional network [shortest centroid–centroid distance = 3.606 (1) Å].
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spelling pubmed-54583072017-06-21 Crystal structure of phenyl N-(3,5-di­methyl­phenyl)carbamate AaminaNaaz, Y. Sathiyaraj, Subramaniyan Kalaimani, Sundararaj Nasar, A. Sultan SubbiahPandi, A. Acta Crystallogr E Crystallogr Commun Research Communications The asymmetric unit of the title compound, C(15)H(15)NO(2), contains two independent mol­ecules (A and B). The di­methyl­phenyl ring, the phenyl ring and the central carbamate N—C(=O)—O group are not coplanar. In mol­ecule A, the di­methyl­phenyl and phenyl rings are inclined to the carbamate group mean plane by 27.71 (13) and 71.70 (4)°, respectively, and to one another by 84.53 (13)°. The corresponding dihedral angles in mol­ecule B are 34.33 (11), 66.32 (13) and 85.48 (12)°, respectively. In the crystal, the A and B mol­ecules are arranged alternately linked through N—H⋯O(carbon­yl) hydrogen bonds, forming –A–B–A–B– chains, which extend along [100]. Within the chains and linking neighbouring chains there are C—H⋯π inter­actions present, forming columns along the a-axis direction. The columns are linked by offset π–π stacking inter­actions, forming a three-dimensional network [shortest centroid–centroid distance = 3.606 (1) Å]. International Union of Crystallography 2017-05-12 /pmc/articles/PMC5458307/ /pubmed/28638642 http://dx.doi.org/10.1107/S2056989017006922 Text en © AaminaNaaz et al. 2017 http://creativecommons.org/licenses/by/2.0/uk/ 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.http://creativecommons.org/licenses/by/2.0/uk/
spellingShingle Research Communications
AaminaNaaz, Y.
Sathiyaraj, Subramaniyan
Kalaimani, Sundararaj
Nasar, A. Sultan
SubbiahPandi, A.
Crystal structure of phenyl N-(3,5-di­methyl­phenyl)carbamate
title Crystal structure of phenyl N-(3,5-di­methyl­phenyl)carbamate
title_full Crystal structure of phenyl N-(3,5-di­methyl­phenyl)carbamate
title_fullStr Crystal structure of phenyl N-(3,5-di­methyl­phenyl)carbamate
title_full_unstemmed Crystal structure of phenyl N-(3,5-di­methyl­phenyl)carbamate
title_short Crystal structure of phenyl N-(3,5-di­methyl­phenyl)carbamate
title_sort crystal structure of phenyl n-(3,5-di­methyl­phenyl)carbamate
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5458307/
https://www.ncbi.nlm.nih.gov/pubmed/28638642
http://dx.doi.org/10.1107/S2056989017006922
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