Crystallography Open Database

Information card for entry 8105597

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Coordinates	8105597.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H20 N2 O S4 V
Calculated formula	C12 H20 N2 O S4 V
Title of publication	Crystal structure of oxidobis(piperidine-1-carbodithioato-κ2 S,S′)vanadium(IV), C12H20N2OS4V
Authors of publication	Machálková, Aneta; Charamzová, Iva; Honzíček, Jan; Vinklárek, Jaromír; Císařová, Ivana
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2019
Journal volume	234
Journal issue	2
Pages of publication	223 - 225
a	7.0892 ± 0.0002 Å
b	8.8797 ± 0.0002 Å
c	13.8486 ± 0.0003 Å
α	87.101 ± 0.001°
β	82.316 ± 0.001°
γ	71.411 ± 0.001°
Cell volume	818.84 ± 0.03 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0291
Residual factor for significantly intense reflections	0.0249
Weighted residual factors for significantly intense reflections	0.0682
Weighted residual factors for all reflections included in the refinement	0.0707
Goodness-of-fit parameter for all reflections included in the refinement	1.097
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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