Crystallography Open Database

Information card for entry 7220801

7220800 << 7220801 >> 7220802

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Coordinates	7220801.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H60 Fe Mo18 N12 O79 P6 Sr
Calculated formula	C30 H60 Fe Mo18 N12 O79 P6 Sr
Title of publication	1,4-Bis(imidazole)butane ligand and strontium(ii) directed 1-D chains based on basket-type molybdophosphates and transition metal (TM) linkers
Authors of publication	Zhang, He; Lv, Jing-Hua; Yu, Kai; Wang, Chun-Mei; Wang, Chun-Xiao; Wang, Lu; Zhou, Bai-Bin
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	32
Pages of publication	6110
a	22.585 ± 0.012 Å
b	13.697 ± 0.007 Å
c	30.282 ± 0.015 Å
α	90°
β	97.645 ± 0.008°
γ	90°
Cell volume	9284 ± 8 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	8
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0769
Residual factor for significantly intense reflections	0.0514
Weighted residual factors for significantly intense reflections	0.087
Weighted residual factors for all reflections included in the refinement	0.1096
Goodness-of-fit parameter for all reflections included in the refinement	1.032
Diffraction radiation wavelength	0.71 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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