Crystallography Open Database

Information card for entry 7044866

Preview

Coordinates	7044866.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H104 N8 O19 V6
Calculated formula	C60 H104 N8 O19 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	10.2063 ± 0.0005 Å
b	21.4566 ± 0.0018 Å
c	16.8058 ± 0.0012 Å
α	90°
β	91.666 ± 0.005°
γ	90°
Cell volume	3678.8 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.1006
Residual factor for significantly intense reflections	0.0774
Weighted residual factors for significantly intense reflections	0.2241
Weighted residual factors for all reflections included in the refinement	0.2525
Goodness-of-fit parameter for all reflections included in the refinement	0.998
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.	7044866.cif
203658	2017-11-28	cif/ Adding structures of 7044864, 7044865, 7044866, 7044867 via cif-deposit CGI script.	7044866.cif