Crystallography Open Database

Information card for entry 4512192

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Coordinates	4512192.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H30 Cu6 Mo12 N24 O40 P
Calculated formula	C42 H30 Cu6 Mo12 N24 O40 P
Title of publication	Planar Cu2(ppz)2Dimers as SBUs for Diverse Polyoxometalate-Based Metal Organic Frameworks
Authors of publication	Qi, Zhi-Kai; Liu, Jun-Liang; Hou, Juan-Juan; Liu, Min-Min; Zhang, Xian-Ming
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	11
Pages of publication	5773
a	17.7586 ± 0.0005 Å
b	17.7586 ± 0.0005 Å
c	19.6912 ± 0.0006 Å
α	90°
β	90°
γ	120°
Cell volume	5378 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0361
Residual factor for significantly intense reflections	0.0316
Weighted residual factors for significantly intense reflections	0.0745
Weighted residual factors for all reflections included in the refinement	0.0763
Goodness-of-fit parameter for all reflections included in the refinement	1.152
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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