Powder X-ray investigation of 4,4′-diisocyano-3,3′-dimethylbiphenyl

Powder X-ray investigation of 4,4′-diisocyano-3,3′-dimethylbiphenyl

The title compound, C16H12N2, was investigated in a powder diffraction study and its structure refined utilizing the Rietveld Method. The molecule has approximate C2 symmetry. The dihedral angle between the rings is 25.6 (7)°. The crystal packing is consolidated by weak C—H...C[tr...

Full description

Bibliographic Details
Main Authors: Mahmoud Al-Ktaifani, Mwaffak Rukiah
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?S1600536813004315
id doaj-f223dc824274418cba8e48f6e661ebd8
record_format Article
spelling doaj-f223dc824274418cba8e48f6e661ebd82020-11-25T02:00:10ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682013-03-01693o412o41310.1107/S1600536813004315Powder X-ray investigation of 4,4′-diisocyano-3,3′-dimethylbiphenylMahmoud Al-KtaifaniMwaffak RukiahThe title compound, C16H12N2, was investigated in a powder diffraction study and its structure refined utilizing the Rietveld Method. The molecule has approximate C2 symmetry. The dihedral angle between the rings is 25.6 (7)°. The crystal packing is consolidated by weak C—H...C[triple-bond]N hydrogen-bond-like contacts, which lead to the formation of a three-dimensional network. Further stabilization of the crystal structure is achived by weak non-covalent π–π interactions between aromatic rings, with a centroid–centroid distance of 3.839 (8) Å.http://scripts.iucr.org/cgi-bin/paper?S1600536813004315
collection DOAJ
language English
format Article
sources DOAJ
author Mahmoud Al-Ktaifani
Mwaffak Rukiah
spellingShingle Mahmoud Al-Ktaifani
Mwaffak Rukiah
Powder X-ray investigation of 4,4′-diisocyano-3,3′-dimethylbiphenyl
Acta Crystallographica Section E
author_facet Mahmoud Al-Ktaifani
Mwaffak Rukiah
author_sort Mahmoud Al-Ktaifani
title Powder X-ray investigation of 4,4′-diisocyano-3,3′-dimethylbiphenyl
title_short Powder X-ray investigation of 4,4′-diisocyano-3,3′-dimethylbiphenyl
title_full Powder X-ray investigation of 4,4′-diisocyano-3,3′-dimethylbiphenyl
title_fullStr Powder X-ray investigation of 4,4′-diisocyano-3,3′-dimethylbiphenyl
title_full_unstemmed Powder X-ray investigation of 4,4′-diisocyano-3,3′-dimethylbiphenyl
title_sort powder x-ray investigation of 4,4′-diisocyano-3,3′-dimethylbiphenyl
publisher International Union of Crystallography
series Acta Crystallographica Section E
issn 1600-5368
publishDate 2013-03-01
description The title compound, C16H12N2, was investigated in a powder diffraction study and its structure refined utilizing the Rietveld Method. The molecule has approximate C2 symmetry. The dihedral angle between the rings is 25.6 (7)°. The crystal packing is consolidated by weak C—H...C[triple-bond]N hydrogen-bond-like contacts, which lead to the formation of a three-dimensional network. Further stabilization of the crystal structure is achived by weak non-covalent π–π interactions between aromatic rings, with a centroid–centroid distance of 3.839 (8) Å.
url http://scripts.iucr.org/cgi-bin/paper?S1600536813004315
work_keys_str_mv AT mahmoudalktaifani powderxrayinvestigationof448242diisocyano338242dimethylbiphenyl
AT mwaffakrukiah powderxrayinvestigationof448242diisocyano338242dimethylbiphenyl
_version_ 1724962040741625856

Similar Items