Crystallography Open Database

Information card for entry 2240757

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Structure parameters

Chemical name	4-Benzamido-2-hydroxybenzoic acid
Formula	C14 H11 N O4
Calculated formula	C14 H11 N O4
SMILES	OC(=O)c1c(O)cc(NC(=O)c2ccccc2)cc1
Title of publication	Crystal structure of 4-benzamido-2-hydroxybenzoic acid
Authors of publication	Shahid, Muhammad; Choudhary, Muhammad Aziz; Butt, Arshad Farooq; Tahir, Muhammad Nawaz; Salim, Muhammad
Journal of publication	Acta Crystallographica Section E
Year of publication	2015
Journal volume	71
Journal issue	6
Pages of publication	o409
a	5.6689 ± 0.0005 Å
b	32.039 ± 0.003 Å
c	6.6413 ± 0.0005 Å
α	90°
β	103.53 ± 0.005°
γ	90°
Cell volume	1172.76 ± 0.18 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.101
Residual factor for significantly intense reflections	0.0568
Weighted residual factors for significantly intense reflections	0.1298
Weighted residual factors for all reflections included in the refinement	0.147
Goodness-of-fit parameter for all reflections included in the refinement	1.042
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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