Crystallography Open Database

Information card for entry 1513885

Preview

Coordinates	1513885.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H23 Cl2 Co N4
Calculated formula	C27 H23 Cl2 Co N4
Title of publication	Synthesis of cationic cobalt(II) complexes and their efficiency as catalysts for the polymerization of 1,3-butadiene
Authors of publication	Liu, Li; Zhang, Xu; Liu, Heng; Zhang, Xuequan; Sun, Guangping; Zhang, Hexin
Journal of publication	Inorganica Chimica Acta
Year of publication	2014
Journal volume	414
Pages of publication	8 - 14
a	10.7724 ± 0.0007 Å
b	10.8378 ± 0.0007 Å
c	10.9523 ± 0.0007 Å
α	85.642 ± 0.001°
β	84.435 ± 0.001°
γ	78.643 ± 0.001°
Cell volume	1245.6 ± 0.14 Å³
Cell temperature	188 ± 2 K
Ambient diffraction temperature	188 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0547
Residual factor for significantly intense reflections	0.046
Weighted residual factors for significantly intense reflections	0.1157
Weighted residual factors for all reflections included in the refinement	0.1217
Goodness-of-fit parameter for all reflections included in the refinement	1.054
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
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.	1513885.cif
107577	2014-03-20	cif/ Adding structures of 1513885 via cif-deposit CGI script.	1513885.cif