Crystallography Open Database

Information card for entry 2206633

2206632 << 2206633 >> 2206634

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Structure parameters

Chemical name	2-Methoxy-4-(phenyliminomethyl)phenol
Formula	C14 H13 N O2
Calculated formula	C14 H13 N O2
SMILES	c1ccccc1/N=C/c1ccc(c(c1)OC)O
Title of publication	2-Methoxy-4-(phenyliminomethyl)phenol
Authors of publication	Lin, Zhi-Dong; Lin, Zhi-Dong; Li, Xing; Huang, Ya-min
Journal of publication	Acta Crystallographica Section E
Year of publication	2005
Journal volume	61
Journal issue	9
Pages of publication	o3032 - o3033
a	17.2192 ± 0.0013 Å
b	18.0407 ± 0.0014 Å
c	15.4424 ± 0.0012 Å
α	90°
β	90°
γ	90°
Cell volume	4797.1 ± 0.6 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	4
Space group number	20
Hermann-Mauguin space group symbol	C 2 2 21
Hall space group symbol	C 2c 2
Residual factor for all reflections	0.0419
Residual factor for significantly intense reflections	0.0358
Weighted residual factors for significantly intense reflections	0.0892
Weighted residual factors for all reflections included in the refinement	0.0934
Goodness-of-fit parameter for all reflections included in the refinement	1.154
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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