Crystal structure of metobromuron

The title compound [systematic name: 3-(4-bromo­phen­yl)-1-meth­oxy-1-methyl­urea], C(9)H(11)BrN(2)O(2), is a phenyl­urea herbicide. The dihedral angle between the plane of the urea group and that of the bromo­phenyl ring is 39.13 (10)°. In the crystal, N—H⋯O and C—H⋯O hydrogen bonds and weak C—H⋯π...

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Autores principales: Kang, Gihaeng, Kim, Jineun, Kwon, Eunjin, Kim, Tae Ho
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Data Reports
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4571412/
https://www.ncbi.nlm.nih.gov/pubmed/26396812
http://dx.doi.org/10.1107/S205698901501347X
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author Kang, Gihaeng
Kim, Jineun
Kwon, Eunjin
Kim, Tae Ho
author_facet Kang, Gihaeng
Kim, Jineun
Kwon, Eunjin
Kim, Tae Ho
author_sort Kang, Gihaeng
collection PubMed
description The title compound [systematic name: 3-(4-bromo­phen­yl)-1-meth­oxy-1-methyl­urea], C(9)H(11)BrN(2)O(2), is a phenyl­urea herbicide. The dihedral angle between the plane of the urea group and that of the bromo­phenyl ring is 39.13 (10)°. In the crystal, N—H⋯O and C—H⋯O hydrogen bonds and weak C—H⋯π inter­actions link adjacent mol­ecules, forming chains along the a-axis direction. In addition, short inter­molecular Br⋯Br contacts [3.648 (4) Å] are present, resulting in a two-dimensional network extending parallel to (101).
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spelling pubmed-45714122015-09-22 Crystal structure of metobromuron Kang, Gihaeng Kim, Jineun Kwon, Eunjin Kim, Tae Ho Acta Crystallogr E Crystallogr Commun Data Reports The title compound [systematic name: 3-(4-bromo­phen­yl)-1-meth­oxy-1-methyl­urea], C(9)H(11)BrN(2)O(2), is a phenyl­urea herbicide. The dihedral angle between the plane of the urea group and that of the bromo­phenyl ring is 39.13 (10)°. In the crystal, N—H⋯O and C—H⋯O hydrogen bonds and weak C—H⋯π inter­actions link adjacent mol­ecules, forming chains along the a-axis direction. In addition, short inter­molecular Br⋯Br contacts [3.648 (4) Å] are present, resulting in a two-dimensional network extending parallel to (101). International Union of Crystallography 2015-07-22 /pmc/articles/PMC4571412/ /pubmed/26396812 http://dx.doi.org/10.1107/S205698901501347X Text en © Kang et al. 2015 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Data Reports
Kang, Gihaeng
Kim, Jineun
Kwon, Eunjin
Kim, Tae Ho
Crystal structure of metobromuron
title Crystal structure of metobromuron
title_full Crystal structure of metobromuron
title_fullStr Crystal structure of metobromuron
title_full_unstemmed Crystal structure of metobromuron
title_short Crystal structure of metobromuron
title_sort crystal structure of metobromuron
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4571412/
https://www.ncbi.nlm.nih.gov/pubmed/26396812
http://dx.doi.org/10.1107/S205698901501347X
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AT kimjineun crystalstructureofmetobromuron
AT kwoneunjin crystalstructureofmetobromuron
AT kimtaeho crystalstructureofmetobromuron

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