Crystallography Open Database

Information card for entry 4105784

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Coordinates	4105784.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C84 H134 Ag16 N11 O60 P8 V8
Calculated formula	C84 H128 Ag16 N11 O60 P8 V8
Title of publication	Silver(I)-Ethynide Clusters Constructed with Phosphonate-Functionized Polyoxovanadates
Authors of publication	Yun-Peng Xie; Thomas C. W. Mak
Journal of publication	Journal of the American Chemical Society
Year of publication	2011
Journal volume	133
Pages of publication	3760 - 3763
a	17.396 ± 0.004 Å
b	25.696 ± 0.006 Å
c	22.829 ± 0.004 Å
α	90°
β	130.765 ± 0.011°
γ	90°
Cell volume	7729 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.128
Residual factor for significantly intense reflections	0.0675
Weighted residual factors for significantly intense reflections	0.1773
Weighted residual factors for all reflections included in the refinement	0.2292
Goodness-of-fit parameter for all reflections included in the refinement	1.032
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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