Crystallography Open Database

Information card for entry 1561968

1561967 << 1561968 >> 1561969

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Coordinates	1561968.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C108 H160 Cu6 Mo36 N48 O122 P3
Calculated formula	C108 H159.96 Cu6 Mo36 N48 O121.96 P3
Title of publication	Assembly of new polyoxometalate‒templated metal‒organic frameworks based on flexible ligands
Authors of publication	Li, Na; Mu, Bao; Lv, Lei; Huang, Rudan
Journal of publication	Journal of Solid State Chemistry
Year of publication	2015
Journal volume	226
Pages of publication	88 - 93
a	22.2807 ± 0.0009 Å
b	22.2807 ± 0.0009 Å
c	12.6044 ± 0.0007 Å
α	90°
β	90°
γ	120°
Cell volume	5418.9 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	147
Hermann-Mauguin space group symbol	P -3
Hall space group symbol	-P 3
Residual factor for all reflections	0.134
Residual factor for significantly intense reflections	0.0854
Weighted residual factors for significantly intense reflections	0.2107
Weighted residual factors for all reflections included in the refinement	0.2544
Goodness-of-fit parameter for all reflections included in the refinement	1.048
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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