Crystallography Open Database

Information card for entry 4344888

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Coordinates	4344888.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H91 N6 O23 V7
Calculated formula	C60 H65 N6 O23 V7
Title of publication	Synthesis and Interconversion of V4, V7, and V8 Oxide Clusters: Unexpected Formation of Neutral Heptanuclear Oxido(alkoxido)vanadium(V) Clusters [V7O17(OR)(4,4'-(t)Bubpy)3] (R = Et, MeOC2H4).
Authors of publication	Kodama, Shintaro; Taya, Nobuto; Inoue, Yuta; Ishii, Youichi
Journal of publication	Inorganic chemistry
Year of publication	2016
Journal volume	55
Journal issue	13
Pages of publication	6712 - 6718
a	16.1487 Å
b	22.1042 Å
c	22.1404 Å
α	90°
β	108.769°
γ	90°
Cell volume	7482.85 Å³
Cell temperature	93 K
Ambient diffraction temperature	93 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1061
Residual factor for significantly intense reflections	0.0831
Weighted residual factors for significantly intense reflections	0.2235
Weighted residual factors for all reflections included in the refinement	0.2428
Goodness-of-fit parameter for all reflections included in the refinement	1.094
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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