Crystallography Open Database

Information card for entry 7058584

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Coordinates	7058584.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H36 N3 O8 V3
Calculated formula	C16 H12 O13 V3
Title of publication	Vanadium(V) complexes of mandelic acid
Authors of publication	Zechel, Filip; Schwendt, Peter; Gyepes, Róbert; Šimunek, Ján; Tatiersky, Jozef; Krivosudsky, Lukas
Journal of publication	New Journal of Chemistry
Year of publication	2019
Journal volume	43
Journal issue	45
Pages of publication	17696 - 17702
a	11.6214 ± 0.0004 Å
b	13.4677 ± 0.0005 Å
c	25.1952 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	3943.4 ± 0.2 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	5
Space group number	57
Hermann-Mauguin space group symbol	P b c m
Hall space group symbol	-P 2c 2b
Residual factor for all reflections	0.0555
Residual factor for significantly intense reflections	0.0391
Weighted residual factors for significantly intense reflections	0.1073
Weighted residual factors for all reflections included in the refinement	0.1174
Goodness-of-fit parameter for all reflections included in the refinement	1.053
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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