Crystallography Open Database

Information card for entry 1516871

Preview

Coordinates	1516871.cif

Structure parameters

Formula	C51 H53.5 Co N4.5 O4 P
Calculated formula	C51 H53.5 Co N4.5 O4 P
Title of publication	Hydrogen-bonding interactions, geometrical selectivity and spectroscopic properties of cobalt(III) complexes with unsymmetrical tridentate amine-amidato-phenolato type ligands
Authors of publication	Ryoji Mitsuhashi; Takayoshi Suzuki; Yukinari Sunatsuki; Masaaki Kojima
Journal of publication	Inorganica Chimica Acta
Year of publication	2013
Journal volume	399
Pages of publication	131 - 137
a	10.8336 ± 0.0007 Å
b	30.9997 ± 0.0017 Å
c	12.8566 ± 0.0009 Å
α	90°
β	92.756 ± 0.003°
γ	90°
Cell volume	4312.7 ± 0.5 Å³
Cell temperature	188 ± 2 K
Ambient diffraction temperature	188 ± 2 K
Number of distinct elements	6
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	0.0513
Residual factor for significantly intense reflections	0.04
Weighted residual factors for significantly intense reflections	0.0985
Weighted residual factors for all reflections included in the refinement	0.1052
Goodness-of-fit parameter for all reflections included in the refinement	1.042
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176435 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2.	1516871.cif
119566	2014-07-07	cif/ Adding structures of 1516871 via cif-deposit CGI script.	1516871.cif