Crystallography Open Database

Information card for entry 7703856

Preview

Coordinates	7703856.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H62 Br4 Co4 N4
Calculated formula	C56 H62 Br4 Co4 N4
Title of publication	Bis(imino)aryl NCN pincer cobalt complexes: synthesis and disproportionation.
Authors of publication	Huang, Li-Cheng; Zhang, Jing-Shun; Jia, Teng; Mu, Ying; Gao, Wei
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	16
Pages of publication	5219 - 5227
a	11.0834 ± 0.0004 Å
b	13.298 ± 0.0004 Å
c	18.3364 ± 0.0007 Å
α	90°
β	94.584 ± 0.001°
γ	90°
Cell volume	2693.9 ± 0.16 Å³
Cell temperature	233 ± 2 K
Ambient diffraction temperature	232.99 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	0.0504
Residual factor for significantly intense reflections	0.042
Weighted residual factors for significantly intense reflections	0.1052
Weighted residual factors for all reflections included in the refinement	0.1108
Goodness-of-fit parameter for all reflections included in the refinement	1.053
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
251623 (current)	2020-05-05	cif/ Updating files of 7703856, 7703857, 7703858, 7703859, 7703860, 7703861 Original log message: Adding full bibliography for 7703856--7703861.cif.	7703856.cif
249722	2020-03-26	cif/ Adding structures of 7703856, 7703857, 7703858, 7703859, 7703860, 7703861 via cif-deposit CGI script.	7703856.cif