Crystallography Open Database

Information card for entry 4304486

Preview

Coordinates	4304486.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37.5 H40.5 Cl2.5 N10 Ni2 O2
Calculated formula	C37.26 H40.48 Cl2.5 N10 Ni2 O2
Title of publication	Transition Metal Complexes of 3-Cyano- and 3-Nitroformazans
Authors of publication	Joe B. Gilroy; Brian O. Patrick; Robert McDonald; Robin G. Hicks
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	1287 - 1294
a	15.3752 ± 0.0008 Å
b	16.4725 ± 0.0008 Å
c	10.6976 ± 0.0005 Å
α	90°
β	132.934 ± 0.002°
γ	90°
Cell volume	1983.63 ± 0.18 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0418
Residual factor for significantly intense reflections	0.0359
Weighted residual factors for significantly intense reflections	0.0968
Weighted residual factors for all reflections included in the refinement	0.1007
Goodness-of-fit parameter for all reflections included in the refinement	1.059
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
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.	4304486.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4304486.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4304486.cif
1163	2010-05-11	cif/4/: committing data from the Inorg-Chem-2008_01-12/ deposition.	4304486.cif