Crystallography Open Database

Information card for entry 4342229

Preview

Coordinates	4342229.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H58 As8 Cu4 N8 O43 V14
Calculated formula	C52 H56 As8 Cu4 N8 O43 V14
Title of publication	Copper-Organic Cationic Ring with an Inserted Arsenic-Vanadium Polyanionic Cluster for Efficient Catalytic Cr(VI) Reduction Using Formic Acid.
Authors of publication	He, Xue-Li; Liu, Yun-Ping; Gong, Kai-Ning; Han, Zhan-Gang; Zhai, Xue-Liang
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	4
Pages of publication	1215 - 1217
a	12.0877 ± 0.0018 Å
b	12.4169 ± 0.0018 Å
c	16.301 ± 0.0018 Å
α	106.261 ± 0.002°
β	109.509 ± 0.002°
γ	93.014 ± 0.002°
Cell volume	2184.9 ± 0.5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0809
Residual factor for significantly intense reflections	0.0625
Weighted residual factors for significantly intense reflections	0.162
Weighted residual factors for all reflections included in the refinement	0.1728
Goodness-of-fit parameter for all reflections included in the refinement	1.032
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
179525 (current)	2016-03-24	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/22.	4342229.cif
132809	2015-03-04	cif/ Updating files of 4342229, 4342230 Original log message: Adding full bibliography for 4342229--4342230.cif.	4342229.cif
130434	2015-02-04	cif/ Adding structures of 4342229, 4342230 via cif-deposit CGI script.	4342229.cif