Crystallography Open Database

Information card for entry 2236415

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Structure parameters

Chemical name	4-[(3-Chloro-2-methylphenyl)iminomethyl]phenol
Formula	C14 H12 Cl N O
Calculated formula	C14 H12 Cl N O
SMILES	Clc1c(c(/N=C/c2ccc(O)cc2)ccc1)C
Title of publication	4-[(3-Chloro-2-methylphenyl)iminomethyl]phenol
Authors of publication	Manjunath, B. C.; Abdoh, M. M. M; Mallesha, L.; Mohana, K. N.; Lokanath, N. K.
Journal of publication	Acta Crystallographica Section E
Year of publication	2012
Journal volume	68
Journal issue	11
Pages of publication	o3191
a	7.5271 ± 0.0009 Å
b	12.4095 ± 0.0015 Å
c	12.58 ± 0.0014 Å
α	90°
β	90°
γ	90°
Cell volume	1175.1 ± 0.2 Å³
Cell temperature	103 K
Ambient diffraction temperature	103 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.052
Residual factor for significantly intense reflections	0.0465
Weighted residual factors for significantly intense reflections	0.1185
Weighted residual factors for all reflections included in the refinement	0.1231
Goodness-of-fit parameter for all reflections included in the refinement	1.069
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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