Crystallography Open Database

Information card for entry 2203169

2203168 << 2203169 >> 2203170

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Coordinates	2203169.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	2-[(2-Hydroxymethylphenylimino)methyl]phenol
Formula	C14 H13 N O2
Calculated formula	C14 H13 N O2
Title of publication	2-[2-(Hydroxymethyl)phenyliminomethyl]phenol
Authors of publication	Ersanlı, Cem Cüneyt; Odabaşoǧlu, Mustafa; Albayrak, Çiǧdem; Erdönmez, Ahmet
Journal of publication	Acta Crystallographica Section E
Year of publication	2004
Journal volume	60
Journal issue	2
Pages of publication	o264 - o266
a	4.5866 ± 0.0004 Å
b	19.742 ± 0.002 Å
c	12.62 ± 0.0011 Å
α	90°
β	94.872 ± 0.007°
γ	90°
Cell volume	1138.6 ± 0.18 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.088
Residual factor for significantly intense reflections	0.044
Weighted residual factors for significantly intense reflections	0.098
Weighted residual factors for all reflections included in the refinement	0.108
Goodness-of-fit parameter for all reflections included in the refinement	0.887
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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