Crystallography Open Database

Information card for entry 4113725

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Coordinates	4113725.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H108 N3 O19 V W5
Calculated formula	C47 N3 O19 W6
Title of publication	51V Magic Angle Spinning NMR Spectroscopy of Six-Coordinate Lindqvist Oxoanions: A Sensitive Probe for the Electronic Environment in Vanadium-Containing Polyoxometalates. Counterions Dictate the 51V Fine Structure Constants in Polyoxometalate Solids
Authors of publication	Wenlin Huang; Louis Todaro; Lynn C. Francesconi; Tatyana Polenova
Journal of publication	Journal of the American Chemical Society
Year of publication	2003
Journal volume	125
Pages of publication	5928 - 5938
a	30.09 ± 0.006 Å
b	18.39 ± 0.003 Å
c	31.967 ± 0.006 Å
α	90°
β	128.1 ± 0.02°
γ	90°
Cell volume	13920 ± 6 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	6
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	0.078
Weighted residual factors for all reflections included in the refinement	0.094
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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