Crystallography Open Database

Information card for entry 2013994

2013993 << 2013994 >> 2013995

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Structure parameters

Chemical name	2-[Benzoyl(hydroxyimino)methylamino]benzoic acid
Formula	C15 H12 N2 O4
Calculated formula	C15 H12 N2 O4
SMILES	N(O)=C(Nc1ccccc1C(=O)O)C(=O)c1ccccc1
Title of publication	2-[Benzoyl(hydroxyimino)methylamino]benzoic acid
Authors of publication	Soylu, Serkan; Tas̨, Murat; Batı, Hümeyra; Çalıs̨kan, Nezihe; Büyükgüngör, Orhan
Journal of publication	Acta Crystallographica Section C
Year of publication	2004
Journal volume	60
Journal issue	4
Pages of publication	o263 - o264
a	20.685 ± 0.0019 Å
b	13.168 ± 0.0013 Å
c	10.488 ± 0.011 Å
α	90°
β	101.921 ± 0.005°
γ	90°
Cell volume	2795 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.077
Residual factor for significantly intense reflections	0.0412
Weighted residual factors for significantly intense reflections	0.0885
Weighted residual factors for all reflections included in the refinement	0.0973
Goodness-of-fit parameter for all reflections included in the refinement	0.862
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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