Crystallography Open Database

Information card for entry 4328311

Preview

Coordinates	4328311.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H32 B Cr Mn N11 O2
Calculated formula	C40 H32 B Cr Mn N11 O2
Title of publication	Chiral Cyanide-Bridged CrIII-MnIII Heterobimetallic Chains Based on [(Tp)Cr(CN)3]-: Synthesis, Structures, and Magnetic Properties
Authors of publication	Min-Xia Yao; Qi Zheng; Xu-Min Cai; Yi-Zhi Li; You Song; Jing-Lin Zuo
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	2140 - 2149
a	13.3781 ± 0.0009 Å
b	14.1119 ± 0.0009 Å
c	20.8914 ± 0.0014 Å
α	90°
β	92.229 ± 0.001°
γ	90°
Cell volume	3941.1 ± 0.5 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	7
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0768
Residual factor for significantly intense reflections	0.0576
Weighted residual factors for significantly intense reflections	0.123
Weighted residual factors for all reflections included in the refinement	0.1286
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	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179386 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/83.	4328311.cif
77276	2013-03-26	cif/ Adding structures of 4328311 via cif-deposit CGI script.	4328311.cif