Crystallography Open Database

Information card for entry 7107839

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Coordinates	7107839.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C66 H43 Mn3 O16
Calculated formula	C66 H36 Mn3 O16
Title of publication	Highly porous and robust ionic MOFs with nia topology constructed by connecting an octahedral ligand and a trigonal prismatic metal cluster
Authors of publication	Fuxing Sun; Jiangtao Jia; Tsolmon Borjigin; Hao Ren; Tingting Zhang; Zheng Bian; Lianxun Gao; Guangshan Zhu
Journal of publication	Chem.Commun.
Year of publication	2012
Journal volume	48
Pages of publication	6010
a	20.0962 ± 0.0003 Å
b	20.0962 ± 0.0003 Å
c	26.9145 ± 0.0009 Å
α	90°
β	90°
γ	120°
Cell volume	9413.4 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	190
Hermann-Mauguin space group symbol	P -6 2 c
Hall space group symbol	P -6c -2c
Residual factor for all reflections	0.0567
Residual factor for significantly intense reflections	0.037
Weighted residual factors for significantly intense reflections	0.0488
Weighted residual factors for all reflections included in the refinement	0.0514
Goodness-of-fit parameter for all reflections included in the refinement	0.944
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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