Crystallography Open Database

Information card for entry 1512484

Preview

Coordinates	1512484.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H47 Co F6 N7 O3 P
Calculated formula	C32 H47 Co F6 N7 O3 P
Title of publication	The effects of tripodal ligands on charge distribution in cobalt(III)-catecholate and cobalt(II)-semiquinonate compounds
Authors of publication	Fan Yu; Bao Li
Journal of publication	Inorganica Chimica Acta
Year of publication	2012
Journal volume	392
Pages of publication	199 - 203
a	9.6337 ± 0.0003 Å
b	14.4703 ± 0.0005 Å
c	14.8189 ± 0.0006 Å
α	108.929 ± 0.004°
β	95.084 ± 0.003°
γ	101.405 ± 0.003°
Cell volume	1889.32 ± 0.13 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0591
Residual factor for significantly intense reflections	0.0477
Weighted residual factors for significantly intense reflections	0.1345
Weighted residual factors for all reflections included in the refinement	0.1394
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1512484.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1512484.cif
89413	2013-10-24	cif/ Adding structures of 1512484 via cif-deposit CGI script.	1512484.cif