Crystallography Open Database

Information card for entry 4305582

Preview

Coordinates	4305582.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H36 N8 O16 V2
Calculated formula	C21 H36 N8 O16 V2
Title of publication	Solid State and Aqueous Solution Characterization of Rectangular Tetranuclear VIV/V-p-Semiquinonate/Hydroquinonate Complexes Exhibiting a Proton Induced Electron Transfer
Authors of publication	Chryssoula Drouza; Anastasios D. Keramidas
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	7211 - 7224
a	19.4212 ± 0.0009 Å
b	11.0769 ± 0.0005 Å
c	29.3388 ± 0.001 Å
α	90°
β	98.816 ± 0.003°
γ	90°
Cell volume	6237 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0516
Residual factor for significantly intense reflections	0.0432
Weighted residual factors for significantly intense reflections	0.119
Weighted residual factors for all reflections included in the refinement	0.1219
Goodness-of-fit parameter for all reflections included in the refinement	1.085
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
179093 (current)	2016-03-23	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/55.	4305582.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4305582.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4305582.cif
1167	2010-05-13	cif/ Adding data from the rest of 2009 RSC journals, Inorg-Chem-2008 and Chem-Comm-2010_18-19.	4305582.cif