Crystallography Open Database

Information card for entry 1551643

Preview

Coordinates	1551643.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H40 Cl4 Co2 N10
Calculated formula	C30 H40 Cl4 Co2 N10
SMILES	[Co]1(Cl)(Cl)[n]2n(CN(c3ccc(N4Cn5[n]([Co](Cl)(Cl)[n]6n(C4)c(cc6C)C)c(cc5C)C)cc3)Cn3[n]1c(cc3C)C)c(cc2C)C
Title of publication	Dinuclear Cobalt(II) Complex with <i>N</i>,<i>N</i>,<i>N</i>′,<i>N</i>′-Tetrakis(3,5-dimethyl-1-pyrazolyl)methyl-1,4-phenylenediamine Having a Tetrahedral Coordination Geometry
Authors of publication	LIM, Jongwan; SON, Young; GU, Gimoon; RYU, Sanghoon; YOSHIOKA, Daisuke; MIKURIYA, Masahiro
Journal of publication	X-ray Structure Analysis Online
Year of publication	2015
Journal volume	31
Journal issue	0
Pages of publication	25
a	12.4671 ± 0.0016 Å
b	10.1719 ± 0.0013 Å
c	29.292 ± 0.004 Å
α	90°
β	101.26 ± 0.003°
γ	90°
Cell volume	3643.1 ± 0.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
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	0.1217
Residual factor for significantly intense reflections	0.0589
Weighted residual factors for significantly intense reflections	0.1034
Weighted residual factors for all reflections included in the refinement	0.1203
Goodness-of-fit parameter for all reflections included in the refinement	0.923
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
216254 (current)	2019-06-20	cif/ Adding structures of 1551643 via cif-deposit CGI script.	1551643.cif