3,4-Diaminobenzonitrile

The non-H atoms in the structure of the title molecule, C7H7N3, are almost coplanar (r.m.s. deviation = 0.018 Å). The two amine groups each donate two and accept one weak N—H...N hydrogen bonds. N—H...N hydrogen bonding between the amine and nitrile groups resu...

Full description

Bibliographic Details
Main Authors: Dylan E. Parsons, David K. Geiger
Format: Article
Language:English
Published: International Union of Crystallography 2013-03-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536813005151
id doaj-bc1d7718ed8d40bc939d5d38fd443ea4
record_format Article
spelling doaj-bc1d7718ed8d40bc939d5d38fd443ea42020-11-24T21:55:29ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682013-03-01693o452o45210.1107/S16005368130051513,4-DiaminobenzonitrileDylan E. ParsonsDavid K. GeigerThe non-H atoms in the structure of the title molecule, C7H7N3, are almost coplanar (r.m.s. deviation = 0.018 Å). The two amine groups each donate two and accept one weak N—H...N hydrogen bonds. N—H...N hydrogen bonding between the amine and nitrile groups results in chains parallel to [101] in the crystal structure. The chains are cross-linked by N—H...N hydrogen bonds between amine groups, giving rise to an infinite three-dimensional network.http://scripts.iucr.org/cgi-bin/paper?S1600536813005151
collection DOAJ
language English
format Article
sources DOAJ
author Dylan E. Parsons
David K. Geiger
spellingShingle Dylan E. Parsons
David K. Geiger
3,4-Diaminobenzonitrile
Acta Crystallographica Section E
author_facet Dylan E. Parsons
David K. Geiger
author_sort Dylan E. Parsons
title 3,4-Diaminobenzonitrile
title_short 3,4-Diaminobenzonitrile
title_full 3,4-Diaminobenzonitrile
title_fullStr 3,4-Diaminobenzonitrile
title_full_unstemmed 3,4-Diaminobenzonitrile
title_sort 3,4-diaminobenzonitrile
publisher International Union of Crystallography
series Acta Crystallographica Section E
issn 1600-5368
publishDate 2013-03-01
description The non-H atoms in the structure of the title molecule, C7H7N3, are almost coplanar (r.m.s. deviation = 0.018 Å). The two amine groups each donate two and accept one weak N—H...N hydrogen bonds. N—H...N hydrogen bonding between the amine and nitrile groups results in chains parallel to [101] in the crystal structure. The chains are cross-linked by N—H...N hydrogen bonds between amine groups, giving rise to an infinite three-dimensional network.
url http://scripts.iucr.org/cgi-bin/paper?S1600536813005151
work_keys_str_mv AT dylaneparsons 34diaminobenzonitrile
AT davidkgeiger 34diaminobenzonitrile
_version_ 1725862327257923584