Crystallography Open Database

Information card for entry 7033211

Preview

Coordinates	7033211.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62.5 H67.33 Mo6 N10.67 O32.83 Zn
Calculated formula	C49.96 H37.98 Mo6 N8.66 O28.33 Zn
Title of publication	Photogeneration of two reduction-active charge-separated states in a hybrid crystal of polyoxometalates and naphthalene diimides.
Authors of publication	Liu, Jian-Jun; Wang, Yao; Lin, Mei-Jin; Huang, Chang-Cang; Dai, Wen-Xin
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	2
Pages of publication	484 - 487
a	18.484 ± 0.004 Å
b	54.534 ± 0.011 Å
c	18.076 ± 0.004 Å
α	90°
β	103.4 ± 0.03°
γ	90°
Cell volume	17725 ± 7 Å³
Cell temperature	113 ± 2 K
Ambient diffraction temperature	113 ± 2 K
Number of distinct elements	6
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	0.115
Residual factor for significantly intense reflections	0.1003
Weighted residual factors for significantly intense reflections	0.2996
Weighted residual factors for all reflections included in the refinement	0.3179
Goodness-of-fit parameter for all reflections included in the refinement	1.135
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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