Crystallography Open Database

Information card for entry 4301136

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Coordinates	4301136.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C106 H90 F12 Mn2 N24 O12 S4
Calculated formula	C106 H90 F12 Mn2 N24 O12 S4
Title of publication	Guest Inclusion and Interpenetration Tuning of Cd(II)/Mn(II) Coordination Grid Networks Assembled from a Rigid Linear Diimidazole Schiff Base Ligand
Authors of publication	Qing Wang; Jianyong Zhang; Chun-Feng Zhuang; Yu Tang; Cheng-Yong Su
Journal of publication	Inorganic Chemistry
Year of publication	2009
Journal volume	48
Pages of publication	287 - 295
a	19.8238 ± 0.0013 Å
b	20.2114 ± 0.0007 Å
c	15.1437 ± 0.0008 Å
α	90°
β	117.056 ± 0.006°
γ	90°
Cell volume	5403.6 ± 0.6 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	7
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0999
Residual factor for significantly intense reflections	0.0423
Weighted residual factors for significantly intense reflections	0.075
Weighted residual factors for all reflections included in the refinement	0.0814
Goodness-of-fit parameter for all reflections included in the refinement	1.018
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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