Cargando…

6-Chloro-N (4),N (4)-dimethyl­pyrimidine-2,4-diamine

The asymmetric unit of the title compound, C(6)H(9)ClN(4), contains four independent mol­ecules (A, B, C and D). Their main difference is the torsion angles, ranging from 1.6 (5) to 5.9 (5)°, between the methyl group and the pyrimidine plane. A pair of inter­molecular N—H⋯N hydrogen bonds link mol­e...

Descripción completa

Detalles Bibliográficos
Autores principales: Pang, Yuan-Yuan, Yu, Kai, Sun, Bin, Guo, Dian-Shun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344442/
https://www.ncbi.nlm.nih.gov/pubmed/22590204
http://dx.doi.org/10.1107/S1600536812013517
_version_ 1782231992658558976
author Pang, Yuan-Yuan
Yu, Kai
Sun, Bin
Guo, Dian-Shun
author_facet Pang, Yuan-Yuan
Yu, Kai
Sun, Bin
Guo, Dian-Shun
author_sort Pang, Yuan-Yuan
collection PubMed
description The asymmetric unit of the title compound, C(6)H(9)ClN(4), contains four independent mol­ecules (A, B, C and D). Their main difference is the torsion angles, ranging from 1.6 (5) to 5.9 (5)°, between the methyl group and the pyrimidine plane. A pair of inter­molecular N—H⋯N hydrogen bonds link mol­ecules A and C into a twisted dimer with a dihedral angle of 32.9 (1)° between the two pyrimidine rings, creating an R (2) (2)(8) motif. In the packing, each two mol­ecules of B, C and D form centrosymmetric dimers through two inter­molecular N—H⋯N hydrogen bonds, locally creating R (2) (2)(8) motifs. The dimers of C and D are alternately bridged by A into an infinite zigzag strip, locally creating two different R (2) (2)(8) motifs with dihedral angles of 32.9 (1) and 63.4 (1)° between the pyrimidine rings. Finally, these strips together with the dimers of B associate into a complicated three-dimensional framework.
format Online
Article
Text
id pubmed-3344442
institution National Center for Biotechnology Information
language English
publishDate 2012
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-33444422012-05-15 6-Chloro-N (4),N (4)-dimethyl­pyrimidine-2,4-diamine Pang, Yuan-Yuan Yu, Kai Sun, Bin Guo, Dian-Shun Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(6)H(9)ClN(4), contains four independent mol­ecules (A, B, C and D). Their main difference is the torsion angles, ranging from 1.6 (5) to 5.9 (5)°, between the methyl group and the pyrimidine plane. A pair of inter­molecular N—H⋯N hydrogen bonds link mol­ecules A and C into a twisted dimer with a dihedral angle of 32.9 (1)° between the two pyrimidine rings, creating an R (2) (2)(8) motif. In the packing, each two mol­ecules of B, C and D form centrosymmetric dimers through two inter­molecular N—H⋯N hydrogen bonds, locally creating R (2) (2)(8) motifs. The dimers of C and D are alternately bridged by A into an infinite zigzag strip, locally creating two different R (2) (2)(8) motifs with dihedral angles of 32.9 (1) and 63.4 (1)° between the pyrimidine rings. Finally, these strips together with the dimers of B associate into a complicated three-dimensional framework. International Union of Crystallography 2012-04-04 /pmc/articles/PMC3344442/ /pubmed/22590204 http://dx.doi.org/10.1107/S1600536812013517 Text en © Pang 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
Pang, Yuan-Yuan
Yu, Kai
Sun, Bin
Guo, Dian-Shun
6-Chloro-N (4),N (4)-dimethyl­pyrimidine-2,4-diamine
title 6-Chloro-N (4),N (4)-dimethyl­pyrimidine-2,4-diamine
title_full 6-Chloro-N (4),N (4)-dimethyl­pyrimidine-2,4-diamine
title_fullStr 6-Chloro-N (4),N (4)-dimethyl­pyrimidine-2,4-diamine
title_full_unstemmed 6-Chloro-N (4),N (4)-dimethyl­pyrimidine-2,4-diamine
title_short 6-Chloro-N (4),N (4)-dimethyl­pyrimidine-2,4-diamine
title_sort 6-chloro-n (4),n (4)-dimethyl­pyrimidine-2,4-diamine
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344442/
https://www.ncbi.nlm.nih.gov/pubmed/22590204
http://dx.doi.org/10.1107/S1600536812013517
work_keys_str_mv AT pangyuanyuan 6chloron4n4dimethylpyrimidine24diamine
AT yukai 6chloron4n4dimethylpyrimidine24diamine
AT sunbin 6chloron4n4dimethylpyrimidine24diamine
AT guodianshun 6chloron4n4dimethylpyrimidine24diamine