Crystallography Open Database

Information card for entry 7237243

Preview

Coordinates	7237243.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H50 Mn9 O44 P4
Calculated formula	C36 H50 Mn9 O44 P4
Title of publication	Manganese cluster-based MOF as efficient polysulfide-trapping platform for high-performance lithium‒sulfur batteries
Authors of publication	Liu, Xiao-Fei; Guo, Xiao-Qing; Wang, Rui; Liu, Qing-Chao; Li, Zhong-Jun; Zang, Shuang-Quan; Mak, Thomas C. W.
Journal of publication	Journal of Materials Chemistry A
Year of publication	2019
Journal volume	7
Journal issue	6
Pages of publication	2838
a	22.5987 ± 0.0002 Å
b	22.5987 ± 0.0002 Å
c	22.5987 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	11541.2 ± 0.18 Å³
Cell temperature	99.97 ± 0.13 K
Ambient diffraction temperature	99.97 ± 0.13 K
Number of distinct elements	5
Space group number	223
Hermann-Mauguin space group symbol	P m -3 n
Hall space group symbol	-P 4n 2 3
Residual factor for all reflections	0.0614
Residual factor for significantly intense reflections	0.0595
Weighted residual factors for significantly intense reflections	0.1722
Weighted residual factors for all reflections included in the refinement	0.1752
Goodness-of-fit parameter for all reflections included in the refinement	1.055
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
237515 (current)	2019-11-24	cif/ Adding structures of 7237242, 7237243 via cif-deposit CGI script.	7237243.cif