Crystallography Open Database

Information card for entry 4349774

Preview

Coordinates	4349774.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Co(L1)2(ClO4)2
Chemical name	1
Formula	C22 H22 Cl2 Co N6 O12
Calculated formula	C22 H22 Cl2 Co N6 O12
Title of publication	Probing the influence of molecular symmetry on the magnetic anisotropy of octahedral cobalt(ii) complexes
Authors of publication	Ding, Zhong-Yu; Meng, Yin-Shan; Xiao, Yi; Zhang, Yi-Quan; Zhu, Yuan-Yuan; Gao, Song
Journal of publication	Inorganic Chemistry Frontiers
Year of publication	2017
Journal volume	4
Journal issue	11
Pages of publication	1909
a	15.9905 ± 0.0011 Å
b	10.9332 ± 0.0008 Å
c	16.8489 ± 0.0012 Å
α	90°
β	102.551 ± 0.001°
γ	90°
Cell volume	2875.3 ± 0.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 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	0.0475
Residual factor for significantly intense reflections	0.0417
Weighted residual factors for significantly intense reflections	0.1217
Weighted residual factors for all reflections included in the refinement	0.1281
Goodness-of-fit parameter for all reflections included in the refinement	1.02
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
235821 (current)	2019-11-24	cif/ Adding structures of 4349774, 4349775, 4349776, 4349777, 4349778, 4349779 via cif-deposit CGI script.	4349774.cif