3-Fluoro-benzoic acid-4-acetyl-pyridine (1/1) at 100 K

Gavin A. Craig; Lynne H. Thomas; Martin S. Adam; Angela Ballantyne; Andrew Cairns; Stephen C. Cairns; Gary Copeland; Clifford Harris; Eve McCalmont; Robert McTaggart; Alan R. G. Martin; Sarah Palmer; Jenna Quail; Harriet Saxby; Duncan J. Sneddon; Graeme Stewart; Neil Thomson; Alex Whyte; Chick C. Wilson; Andrew Parkin

doi:10.1107/S1600536809002396

3-Fluoro-benzoic acid-4-acetyl-pyridine (1/1) at 100 K

Gavin A. Craig
, Lynne H. Thomas (Lead / Corresponding author)
, Martin S. Adam
, Angela Ballantyne
, Andrew Cairns
, Stephen C. Cairns
, Gary Copeland
, Clifford Harris
, Eve McCalmont
, Robert McTaggart
, Alan R. G. Martin
, Sarah Palmer
, Jenna Quail
, Harriet Saxby
, Duncan J. Sneddon
, Graeme Stewart
, Neil Thomson
, Alex Whyte
, Chick C. Wilson
, Andrew Parkin

Drug Discovery Unit

Research output: Contribution to journal › Article › peer-review

4 Citations (Scopus)

Abstract

In the title compound, C7H5FO2·C7H7NO, a moderate-strength hydrogen bond is formed between the carboxyl group of one mol-ecule and the pyridine N atom of the other. The benzoic acid mol-ecule is observed to be disordered over two positions with the second orientation only 4% occupied. This disorder is also reflected in the presence of diffuse scattering in the diffraction pattern.

Original language	English
Pages (from-to)	o380
Number of pages	1
Journal	Acta Crystallographica Section E: Structure Reports Online
Volume	65
Issue number	2
Early online date	23 Jan 2009
DOIs	https://doi.org/10.1107/S1600536809002396
Publication status	Published - 23 Feb 2009

ASJC Scopus subject areas

General Chemistry
General Materials Science
Condensed Matter Physics

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Craig, G. A., Thomas, L. H., Adam, M. S., Ballantyne, A., Cairns, A., Cairns, S. C., Copeland, G., Harris, C., McCalmont, E., McTaggart, R., Martin, A. R. G., Palmer, S., Quail, J., Saxby, H., Sneddon, D. J., Stewart, G., Thomson, N., Whyte, A., Wilson, C. C., & Parkin, A. (2009). 3-Fluoro-benzoic acid-4-acetyl-pyridine (1/1) at 100 K. Acta Crystallographica Section E: Structure Reports Online, 65(2), o380. https://doi.org/10.1107/S1600536809002396

@article{e78e6a1bce5247878561d39f3aa9916e,

title = "3-Fluoro-benzoic acid-4-acetyl-pyridine (1/1) at 100 K",

abstract = "In the title compound, C7H5FO2·C7H7NO, a moderate-strength hydrogen bond is formed between the carboxyl group of one mol-ecule and the pyridine N atom of the other. The benzoic acid mol-ecule is observed to be disordered over two positions with the second orientation only 4\% occupied. This disorder is also reflected in the presence of diffuse scattering in the diffraction pattern.",

author = "Craig, \{Gavin A.\} and Thomas, \{Lynne H.\} and Adam, \{Martin S.\} and Angela Ballantyne and Andrew Cairns and Cairns, \{Stephen C.\} and Gary Copeland and Clifford Harris and Eve McCalmont and Robert McTaggart and Martin, \{Alan R. G.\} and Sarah Palmer and Jenna Quail and Harriet Saxby and Sneddon, \{Duncan J.\} and Graeme Stewart and Neil Thomson and Alex Whyte and Wilson, \{Chick C.\} and Andrew Parkin",

year = "2009",

month = feb,

day = "23",

doi = "10.1107/S1600536809002396",

language = "English",

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

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Craig, GA, Thomas, LH, Adam, MS, Ballantyne, A, Cairns, A, Cairns, SC, Copeland, G, Harris, C, McCalmont, E, McTaggart, R, Martin, ARG, Palmer, S, Quail, J, Saxby, H, Sneddon, DJ, Stewart, G, Thomson, N, Whyte, A, Wilson, CC & Parkin, A 2009, '3-Fluoro-benzoic acid-4-acetyl-pyridine (1/1) at 100 K', Acta Crystallographica Section E: Structure Reports Online, vol. 65, no. 2, pp. o380. https://doi.org/10.1107/S1600536809002396

TY - JOUR

T1 - 3-Fluoro-benzoic acid-4-acetyl-pyridine (1/1) at 100 K

AU - Craig, Gavin A.

AU - Thomas, Lynne H.

AU - Adam, Martin S.

AU - Ballantyne, Angela

AU - Cairns, Andrew

AU - Cairns, Stephen C.

AU - Copeland, Gary

AU - Harris, Clifford

AU - McCalmont, Eve

AU - McTaggart, Robert

AU - Martin, Alan R. G.

AU - Palmer, Sarah

AU - Quail, Jenna

AU - Saxby, Harriet

AU - Sneddon, Duncan J.

AU - Stewart, Graeme

AU - Thomson, Neil

AU - Whyte, Alex

AU - Wilson, Chick C.

AU - Parkin, Andrew

PY - 2009/2/23

Y1 - 2009/2/23

N2 - In the title compound, C7H5FO2·C7H7NO, a moderate-strength hydrogen bond is formed between the carboxyl group of one mol-ecule and the pyridine N atom of the other. The benzoic acid mol-ecule is observed to be disordered over two positions with the second orientation only 4% occupied. This disorder is also reflected in the presence of diffuse scattering in the diffraction pattern.

AB - In the title compound, C7H5FO2·C7H7NO, a moderate-strength hydrogen bond is formed between the carboxyl group of one mol-ecule and the pyridine N atom of the other. The benzoic acid mol-ecule is observed to be disordered over two positions with the second orientation only 4% occupied. This disorder is also reflected in the presence of diffuse scattering in the diffraction pattern.

UR - https://www.scopus.com/pages/publications/60349112210

U2 - 10.1107/S1600536809002396

DO - 10.1107/S1600536809002396

M3 - Article

AN - SCOPUS:60349112210

SN - 1600-5368

VL - 65

SP - o380

JO - Acta Crystallographica Section E: Structure Reports Online

JF - Acta Crystallographica Section E: Structure Reports Online

IS - 2

ER -

3-Fluoro-benzoic acid-4-acetyl-pyridine (1/1) at 100 K

Abstract

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