Crystallography Open Database

Information card for entry 4309273

Preview

Coordinates	4309273.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H38 Cl4 O23 V4
Calculated formula	C8 H32 Cl3.138 O22.1 V4
Title of publication	Characterization of Novel Vanadium(III)/Acetate Clusters Formed in Aqueous Solution
Authors of publication	Fiona H. Fry; Brenda A. Dougan; Nichola McCann; Christopher J. Ziegler; Nicola E. Brasch
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	5197 - 5199
a	17.7698 ± 0.0011 Å
b	17.7698 ± 0.0011 Å
c	11.39 ± 0.0014 Å
α	90°
β	90°
γ	90°
Cell volume	3596.6 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	136
Hermann-Mauguin space group symbol	P 42/m n m
Hall space group symbol	-P 4n 2n
Residual factor for all reflections	0.0888
Residual factor for significantly intense reflections	0.0843
Weighted residual factors for significantly intense reflections	0.2104
Weighted residual factors for all reflections included in the refinement	0.2126
Goodness-of-fit parameter for all reflections included in the refinement	1.08
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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