Crystallography Open Database

Information card for entry 7714241

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Coordinates	7714241.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C58 H69 Cu Mo16 N9 O58
Calculated formula	C56 H49 Cu Mo16 N8 O53
Title of publication	A Series of Isopolymolybdate-viologen Hybrids with Photo-, Thermo- and Electro-chromic Properties
Authors of publication	Yu, Shuang; Liu, Tao; Ying, Jun; Tian, Aixiang; Yang, Mengle; Wang, Xiuli
Journal of publication	Dalton Transactions
Year of publication	2023
a	15.3467 ± 0.0003 Å
b	16.5545 ± 0.0003 Å
c	21.5569 ± 0.0004 Å
α	96.175 ± 0.001°
β	101.521 ± 0.001°
γ	110.172 ± 0.001°
Cell volume	4943.62 ± 0.17 Å³
Cell temperature	296.15 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0764
Residual factor for significantly intense reflections	0.0497
Weighted residual factors for significantly intense reflections	0.1157
Weighted residual factors for all reflections included in the refinement	0.1315
Goodness-of-fit parameter for all reflections included in the refinement	1.031
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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