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N,N′-Dibenzyl-N′′-(2,4-difluorobenzoyl)-N,N′-dimethylphosphoric triamide
In the title molecule, C(23)H(24)F(2)N(3)O(2)P, the P atom is in a distorted tetrahedral P(=O)(N)(N)(2) environment, with the bond angles around the P atom in the range 106.78 (11)–114.10 (13)°. The phosphoryl and carbonyl groups, which are separated by an N atom, adopt an anti orientation relativ...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3274968/ https://www.ncbi.nlm.nih.gov/pubmed/22346913 http://dx.doi.org/10.1107/S1600536811055115 |
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author | Pourayoubi, Mehrdad Shoghpour, Samad Torre-Fernández, Laura García-Granda, Santiago |
author_facet | Pourayoubi, Mehrdad Shoghpour, Samad Torre-Fernández, Laura García-Granda, Santiago |
author_sort | Pourayoubi, Mehrdad |
collection | PubMed |
description | In the title molecule, C(23)H(24)F(2)N(3)O(2)P, the P atom is in a distorted tetrahedral P(=O)(N)(N)(2) environment, with the bond angles around the P atom in the range 106.78 (11)–114.10 (13)°. The phosphoryl and carbonyl groups, which are separated by an N atom, adopt an anti orientation relative to each other. In the C(=O)NHP(=O) fragment, the P—N bond is longer [1.683 (2) Å] and the O—P—N angle is smaller [106.78 (11)°] than the other P—N bonds [1.613 (2) and 1.632 (2) Å] and O—P—N bond angles [114.10 (13) and 110.83 (12)°], respectively. The N atoms have sp (2) character. In the crystal, pairs of P=O⋯H—N hydrogen bonds form inversion dimers with R (2) (2)(8) ring motifs. |
format | Online Article Text |
id | pubmed-3274968 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-32749682012-02-15 N,N′-Dibenzyl-N′′-(2,4-difluorobenzoyl)-N,N′-dimethylphosphoric triamide Pourayoubi, Mehrdad Shoghpour, Samad Torre-Fernández, Laura García-Granda, Santiago Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title molecule, C(23)H(24)F(2)N(3)O(2)P, the P atom is in a distorted tetrahedral P(=O)(N)(N)(2) environment, with the bond angles around the P atom in the range 106.78 (11)–114.10 (13)°. The phosphoryl and carbonyl groups, which are separated by an N atom, adopt an anti orientation relative to each other. In the C(=O)NHP(=O) fragment, the P—N bond is longer [1.683 (2) Å] and the O—P—N angle is smaller [106.78 (11)°] than the other P—N bonds [1.613 (2) and 1.632 (2) Å] and O—P—N bond angles [114.10 (13) and 110.83 (12)°], respectively. The N atoms have sp (2) character. In the crystal, pairs of P=O⋯H—N hydrogen bonds form inversion dimers with R (2) (2)(8) ring motifs. International Union of Crystallography 2012-01-07 /pmc/articles/PMC3274968/ /pubmed/22346913 http://dx.doi.org/10.1107/S1600536811055115 Text en © Pourayoubi et al. 2012 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 | Organic Papers Pourayoubi, Mehrdad Shoghpour, Samad Torre-Fernández, Laura García-Granda, Santiago N,N′-Dibenzyl-N′′-(2,4-difluorobenzoyl)-N,N′-dimethylphosphoric triamide |
title |
N,N′-Dibenzyl-N′′-(2,4-difluorobenzoyl)-N,N′-dimethylphosphoric triamide |
title_full |
N,N′-Dibenzyl-N′′-(2,4-difluorobenzoyl)-N,N′-dimethylphosphoric triamide |
title_fullStr |
N,N′-Dibenzyl-N′′-(2,4-difluorobenzoyl)-N,N′-dimethylphosphoric triamide |
title_full_unstemmed |
N,N′-Dibenzyl-N′′-(2,4-difluorobenzoyl)-N,N′-dimethylphosphoric triamide |
title_short |
N,N′-Dibenzyl-N′′-(2,4-difluorobenzoyl)-N,N′-dimethylphosphoric triamide |
title_sort | n,n′-dibenzyl-n′′-(2,4-difluorobenzoyl)-n,n′-dimethylphosphoric triamide |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3274968/ https://www.ncbi.nlm.nih.gov/pubmed/22346913 http://dx.doi.org/10.1107/S1600536811055115 |
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