Crystallography Open Database

Information card for entry 7239535

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Coordinates	7239535.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C69 H42 O14 Pb3
Calculated formula	C69 H42 O14 Pb3
Title of publication	Trigonal prism or octahedron: the conformational change of a dendritic six-node ligand in MOFs
Authors of publication	Jia, Jiangtao; Sun, Fuxing; Ma, Heping; Wang, Lei; Cai, Kun; Bian, Zheng; Gao, Lianxun; Zhu, Guangshan
Journal of publication	Journal of Materials Chemistry A
Year of publication	2013
Journal volume	1
Journal issue	35
Pages of publication	10112
a	26.4685 ± 0.0012 Å
b	22.6646 ± 0.0011 Å
c	40.1626 ± 0.0018 Å
α	90°
β	100.171 ± 0.001°
γ	90°
Cell volume	23714.8 ± 1.9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1188
Residual factor for significantly intense reflections	0.0723
Weighted residual factors for significantly intense reflections	0.213
Weighted residual factors for all reflections included in the refinement	0.2316
Goodness-of-fit parameter for all reflections included in the refinement	0.961
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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