Crystallography Open Database

Information card for entry 7030973

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Coordinates	7030973.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C74 H60 N6 O12 P2 V3
Calculated formula	C74 H60 N6 O12 P2 V3
Title of publication	Di-, tri- and tetranuclear molecular vanadium phosphonates: a chloride encapsulated tetranuclear bowl.
Authors of publication	Sahoo, Dipankar; Suriyanarayanan, Ramakirushnan; Chandrasekhar, Vadapalli
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	28
Pages of publication	10898 - 10909
a	26.464 ± 0.005 Å
b	27.628 ± 0.005 Å
c	14.057 ± 0.005 Å
α	90°
β	91.213 ± 0.005°
γ	90°
Cell volume	10275 ± 5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.1673
Residual factor for significantly intense reflections	0.1179
Weighted residual factors for significantly intense reflections	0.3111
Weighted residual factors for all reflections included in the refinement	0.346
Goodness-of-fit parameter for all reflections included in the refinement	1.056
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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