Crystallography Open Database

Information card for entry 4308125

Preview

Coordinates	4308125.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H62 Cu4 N8 O15 V4
Calculated formula	C104 H124 Cu8 N16 O30 V8
Title of publication	Unprecedented Eight-Connected Self-catenated Network Based on Heterometallic {Cu4V4O12} Clusters as Nodes
Authors of publication	Xiaoshu Qu; Lin Xu; Guanggang Gao; Fengyan Li; Yanyan Yang
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	4775 - 4777
a	12.56 ± 0.005 Å
b	9.927 ± 0.005 Å
c	26.238 ± 0.005 Å
α	90°
β	115.121 ± 0.012°
γ	90°
Cell volume	2962 ± 2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.1476
Residual factor for significantly intense reflections	0.0675
Weighted residual factors for significantly intense reflections	0.1445
Weighted residual factors for all reflections included in the refinement	0.1797
Goodness-of-fit parameter for all reflections included in the refinement	1.034
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179119 (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 4/30/81.	4308125.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4308125.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4308125.cif
1194	2010-06-06	cif/4/ Adding data from Inorg-Chem-2007_01-13/ processing directory.	4308125.cif