Crystallography Open Database

Information card for entry 7057848

Preview

Coordinates	7057848.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45 H54 Fe0.5 Mo18 N15 Na0.5 O79.5 P6 Sr
Calculated formula	C45 H54 Fe0.5 Mo18 N15 Na0.5 O79.5 P6 Sr
Title of publication	Long rigid ligand induced basket-type phosphomolybdate photo-/electro-catalytic materials
Authors of publication	Meng, Fan-xue; Lv, Jing-hua; Yu, Kai; Zhang, Mao-lin; Wang, Kun-peng; Zhou, Bai-bin
Journal of publication	New Journal of Chemistry
Year of publication	2018
Journal volume	42
Journal issue	24
Pages of publication	19528
a	15.272 ± 0.0004 Å
b	16.6739 ± 0.0004 Å
c	23.3482 ± 0.0006 Å
α	87.304 ± 0.001°
β	74.408 ± 0.001°
γ	66.152 ± 0.001°
Cell volume	5224.9 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	9
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.058
Residual factor for significantly intense reflections	0.0421
Weighted residual factors for significantly intense reflections	0.0986
Weighted residual factors for all reflections included in the refinement	0.107
Goodness-of-fit parameter for all reflections included in the refinement	1.063
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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