Crystallography Open Database

Information card for entry 7022317

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Coordinates	7022317.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H148 N6 O120.68 P34 V18
Calculated formula	C42 H154 N6 O120.68 P34 V18
Title of publication	Amine templated open-framework vanadium(III) phosphites with catalytic properties.
Authors of publication	Orive, Joseba; Larrea, Edurne S.; Fernández de Luis, Roberto; Iglesias, Marta; Mesa, José L; Rojo, Teófilo; Arriortua, María I
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	13
Pages of publication	4500 - 4512
a	13.4125 ± 0.0001 Å
b	13.4125 ± 0.0001 Å
c	27.8003 ± 0.0003 Å
α	90°
β	90°
γ	120°
Cell volume	4331.11 ± 0.07 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor for all reflections	0.045
Residual factor for significantly intense reflections	0.0438
Weighted residual factors for significantly intense reflections	0.128
Weighted residual factors for all reflections included in the refinement	0.1298
Goodness-of-fit parameter for all reflections included in the refinement	1.096
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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