Crystallography Open Database

Information card for entry 4114333

Preview

Coordinates	4114333.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H36 Co N14 S2
Calculated formula	C50 H36 Co N14 S2
Title of publication	Magnetic Properties of Tetrakis[4-(α-diazobenzyl)pyridine]bis(thiocyanato-N)cobalt(II) in Frozen Solution after Irradiation. Formation of a Single-Molecule Magnet in Frozen Solution
Authors of publication	Satoru Karasawa; Guangyuan Zhou; Hiroshi Morikawa; Noboru Koga
Journal of publication	Journal of the American Chemical Society
Year of publication	2003
Journal volume	125
Pages of publication	13676 - 13677
a	10.367 ± 0.006 Å
b	11.437 ± 0.006 Å
c	19.44 ± 0.01 Å
α	90°
β	102.35 ± 0.03°
γ	90°
Cell volume	2252 ± 2 Å³
Cell temperature	123.1 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for significantly intense reflections	0.039
Weighted residual factors for all reflections included in the refinement	0.081
Goodness-of-fit parameter for all reflections included in the refinement	1.094
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4114333.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4114333.cif
67630	2012-10-01	cif/ Adding structures of 4114333 via cif-deposit CGI script.	4114333.cif