Crystallography Open Database

Information card for entry 7044867

Preview

Coordinates	7044867.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H96 N8 O21 V6
Calculated formula	C48 H96 N8 O21 V6
Title of publication	Diversified polyoxovanadate derivatives obtained by copper(i)-catalysed azide-alkyne cycloaddition reaction: their synthesis and structural characterization.
Authors of publication	Jia, Hongli; Li, Qi; Bayaguud, Aruuhan; Huang, Yichao; She, Shan; Chen, Kun; Wei, Yongge
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	2
Pages of publication	577 - 584
a	17.1864 ± 0.0007 Å
b	15.7148 ± 0.0005 Å
c	25.1531 ± 0.0008 Å
α	90°
β	97.715 ± 0.003°
γ	90°
Cell volume	6731.9 ± 0.4 Å³
Cell temperature	173 ± 0.1 K
Ambient diffraction temperature	173 ± 0.1 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 all reflections	0.0921
Residual factor for significantly intense reflections	0.0781
Weighted residual factors for significantly intense reflections	0.2203
Weighted residual factors for all reflections included in the refinement	0.2381
Goodness-of-fit parameter for all reflections included in the refinement	1.062
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
229575 (current)	2019-11-17	cif/ Updating files of 7044864, 7044865, 7044866, 7044867 Original log message: Adding full bibliography for 7044864--7044867.cif.	7044867.cif
203658	2017-11-28	cif/ Adding structures of 7044864, 7044865, 7044866, 7044867 via cif-deposit CGI script.	7044867.cif