N-(4-Bromophenyl)-3,5-dinitrobenzamide

Sohail Saeed; Naghmana Rashid; Rizwan Hussain; Wing Tak Wong

doi:10.1107/S1600536811051464

N-(4-Bromophenyl)-3,5-dinitrobenzamide

Sohail Saeed, Naghmana Rashid, Rizwan Hussain, Wing Tak Wong

Research output: Journal article publication › Journal article › Academic research › peer-review

2 Citations (Scopus)

Abstract

The title molecule, C 13H 8BrN 3O 5, is slightly twisted, with the dihedral angle between the two benzene rings being 5.9(1)°. In the crystal, N-H··· O hydrogen bonds link the molecules into one-dimensional chains running along [101]. Further stabilization of the crystal structure is provided by π-π interactions [shortest centroid-centroid distance = 3.6467(17) Å].

Original language	English
Journal	Acta Crystallographica Section E: Structure Reports Online
Volume	68
Issue number	1
DOIs	https://doi.org/10.1107/S1600536811051464
Publication status	Published - 1 Jan 2012
Externally published	Yes

Keywords

Data-to-parameter ratio = 12.1
Mean σ(C-C) = 0.004 Å
R factor = 0.035
Single-crystal X-ray study
T = 296 K
wR factor = 0.108

ASJC Scopus subject areas

General Chemistry
General Materials Science
Condensed Matter Physics

More information

10.1107/S1600536811051464

Cite this

@article{d5ce9edd37864e1ea2cee02b890d8b3e,

title = "N-(4-Bromophenyl)-3,5-dinitrobenzamide",

abstract = "The title molecule, C 13H 8BrN 3O 5, is slightly twisted, with the dihedral angle between the two benzene rings being 5.9(1)°. In the crystal, N-H··· O hydrogen bonds link the molecules into one-dimensional chains running along [101]. Further stabilization of the crystal structure is provided by π-π interactions [shortest centroid-centroid distance = 3.6467(17) {\AA}].",

keywords = "Data-to-parameter ratio = 12.1, Mean σ(C-C) = 0.004 {\AA}, R factor = 0.035, Single-crystal X-ray study, T = 296 K, wR factor = 0.108",

author = "Sohail Saeed and Naghmana Rashid and Rizwan Hussain and Wong, {Wing Tak}",

year = "2012",

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language = "English",

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journal = "Acta Crystallographica Section E: Structure Reports Online",

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TY - JOUR

T1 - N-(4-Bromophenyl)-3,5-dinitrobenzamide

AU - Saeed, Sohail

AU - Rashid, Naghmana

AU - Hussain, Rizwan

AU - Wong, Wing Tak

PY - 2012/1/1

Y1 - 2012/1/1

N2 - The title molecule, C 13H 8BrN 3O 5, is slightly twisted, with the dihedral angle between the two benzene rings being 5.9(1)°. In the crystal, N-H··· O hydrogen bonds link the molecules into one-dimensional chains running along [101]. Further stabilization of the crystal structure is provided by π-π interactions [shortest centroid-centroid distance = 3.6467(17) Å].

AB - The title molecule, C 13H 8BrN 3O 5, is slightly twisted, with the dihedral angle between the two benzene rings being 5.9(1)°. In the crystal, N-H··· O hydrogen bonds link the molecules into one-dimensional chains running along [101]. Further stabilization of the crystal structure is provided by π-π interactions [shortest centroid-centroid distance = 3.6467(17) Å].

KW - Data-to-parameter ratio = 12.1

KW - Mean σ(C-C) = 0.004 Å

KW - R factor = 0.035

KW - Single-crystal X-ray study

KW - T = 296 K

KW - wR factor = 0.108

UR - http://www.scopus.com/inward/record.url?scp=84855410665&partnerID=8YFLogxK

U2 - 10.1107/S1600536811051464

DO - 10.1107/S1600536811051464

M3 - Journal article

SN - 1600-5368

VL - 68

JO - Acta Crystallographica Section E: Structure Reports Online

JF - Acta Crystallographica Section E: Structure Reports Online

IS - 1

ER -

N-(4-Bromophenyl)-3,5-dinitrobenzamide

Abstract

Keywords

ASJC Scopus subject areas

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