Crystal structure of the co-crystal butylparaben–isonicotinamide (1/1)
File(s)
Published version
Author(s)
Bhardwaj, RM
Yang, H
Florence, AJ
Type
Journal Article
Abstract
The title 1:1 co-crystal, C11H14O3C6H6N2O [systematic name: butyl 4-hydroxybenzoate–isonicotinamide
(1/1)], crystallizes with one molecule of butylparaben
(BPN) and one molecule of isonicotinamide (ISN) in the asymmetric unit. In the
crystal, BPN and ISN molecules form hydrogen-bonded (O—HN and N—
HO) dimers of paired BPN and ISN molecules. These dimers are further
connected to each other via N—HO C hydrogen bonds, creating ribbons in
[011] which further stack along the a axis to form a layered structure with short
CC contacts of 3.285 (3) A˚ . Packing interactions within the crystal structure
were assessed using PIXEL calculations.
(1/1)], crystallizes with one molecule of butylparaben
(BPN) and one molecule of isonicotinamide (ISN) in the asymmetric unit. In the
crystal, BPN and ISN molecules form hydrogen-bonded (O—HN and N—
HO) dimers of paired BPN and ISN molecules. These dimers are further
connected to each other via N—HO C hydrogen bonds, creating ribbons in
[011] which further stack along the a axis to form a layered structure with short
CC contacts of 3.285 (3) A˚ . Packing interactions within the crystal structure
were assessed using PIXEL calculations.
Date Issued
2015-12-07
Date Acceptance
2015-12-07
Citation
Acta Crystallographica Section E: Crystallographic Communications, 2015, 72 (1), pp.53-55
ISSN
2056-9890
Publisher
International Union of Crystallography
Start Page
53
End Page
55
Journal / Book Title
Acta Crystallographica Section E: Crystallographic Communications
Volume
72
Issue
1
Copyright Statement
This is an open access article
Notes
journal: Acta Crystallographica Section E: Crystallographic Communications content_type: research communications peer_reviewed: Yes review_process: Single blind received: 31 August 2015 accepted: 7 December 2015 published_online: 1 January 2016 supplementary_materials: This article has supporting information copyright: © 2016 Bhardwaj license: Creative Commons Attribution (CC-BY)
Publication Status
Published