Crystallography Open Database

Information card for entry 2237548

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Structure parameters

Chemical name	4,4'-(Ethene-1,2-diyl)dipyridinium 4-[2-(pyridin-4-yl)ethenyl]pyridinium octacyanidomolybdate(V) tetrahydrate
Formula	C32 H31 Mo N12 O4
Calculated formula	C32 H31 Mo N12 O4
Title of publication	4,4'-(Ethene-1,2-diyl)dipyridinium 4-[2-(pyridin-4-yl)ethenyl]pyridinium octacyanidomolybdate(V) tetrahydrate
Authors of publication	Yang, Xiao-Zhen; Hu, Ai-Yun; Yuan, Ai-Hua
Journal of publication	Acta Crystallographica Section E
Year of publication	2013
Journal volume	69
Journal issue	3
Pages of publication	m132
a	12.403 ± 0.003 Å
b	16.534 ± 0.003 Å
c	15.37 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	3151.9 ± 1.1 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	5
Space group number	68
Hermann-Mauguin space group symbol	C c c a :2
Hall space group symbol	-C 2a 2ac
Residual factor for all reflections	0.0215
Residual factor for significantly intense reflections	0.0205
Weighted residual factors for significantly intense reflections	0.051
Weighted residual factors for all reflections included in the refinement	0.0516
Goodness-of-fit parameter for all reflections included in the refinement	1.085
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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