Crystallography Open Database

Information card for entry 7043555

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Coordinates	7043555.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C126 H97 Cu2 Mn Mo6 N10 O26 P4
Calculated formula	C126 H97 Cu2 Mn Mo6 N10 O26 P4
Title of publication	Structural and reactivity insights into covalently linked Cu(I) complex-Anderson polyoxometalates
Authors of publication	Schönweiz, Stefanie; Sorsche, Dieter; Schwarz, Benjamin; Rau, Sven; Streb, Carsten
Journal of publication	Dalton Trans.
Year of publication	2017
a	18.4673 ± 0.0004 Å
b	19.496 ± 0.0003 Å
c	25.0204 ± 0.0004 Å
α	83.4393 ± 0.0014°
β	78.023 ± 0.0016°
γ	66.0723 ± 0.0018°
Cell volume	8050.3 ± 0.3 Å³
Cell temperature	150.05 ± 0.1 K
Ambient diffraction temperature	150.05 ± 0.1 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0718
Residual factor for significantly intense reflections	0.0583
Weighted residual factors for significantly intense reflections	0.1653
Weighted residual factors for all reflections included in the refinement	0.1785
Goodness-of-fit parameter for all reflections included in the refinement	1.066
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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