Crystallography Open Database

Information card for entry 1562305

Preview

Coordinates	1562305.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H72 Mo12 N10 Na Ni3 O82 P8
Calculated formula	C52 H72 Mo12 N10 Na Ni3 O82 P8
Title of publication	Assembly of three organic‒inorganic hybrid supramolecular materials based on reduced molybdenum(V) phosphates
Authors of publication	Zhang, He; Yu, Kai; Lv, Jing-Hua; Wang, Chun-Mei; Wang, Chun-Xiao; Zhou, Bai-Bin
Journal of publication	Journal of Solid State Chemistry
Year of publication	2014
Journal volume	217
Pages of publication	22 - 30
a	21.0239 ± 0.0017 Å
b	23.502 ± 0.0018 Å
c	15.592 ± 0.002 Å
α	90°
β	131.102 ± 0.001°
γ	90°
Cell volume	5805.3 ± 1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	8
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	0.075
Residual factor for significantly intense reflections	0.0415
Weighted residual factors for significantly intense reflections	0.0912
Weighted residual factors for all reflections included in the refinement	0.1025
Goodness-of-fit parameter for all reflections included in the refinement	1.073
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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