Crystallography Open Database

Information card for entry 4307902

Preview

Coordinates	4307902.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	COPPER-ETYLENEDIAMINE POLUOXONIOBATE
Formula	C4.8 H29.6 Cu1.2 N4.8 Nb2.4 O13.24
Calculated formula	C4.8 H29.6 Cu1.2 N4.8 Nb2.4 O13.24
Title of publication	Copper-Linked Hexaniobate Lindqvist Clusters Variations on a Theme
Authors of publication	Ranko P. Bontchev; Eugene L. Venturini; May Nyman
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	4483 - 4491
a	12.6242 ± 0.001 Å
b	12.6577 ± 0.001 Å
c	16.4412 ± 0.0013 Å
α	74.622 ± 0.001°
β	88.541 ± 0.001°
γ	81.502 ± 0.001°
Cell volume	2505.1 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.0264
Residual factor for significantly intense reflections	0.0245
Weighted residual factors for significantly intense reflections	0.0657
Weighted residual factors for all reflections included in the refinement	0.0743
Goodness-of-fit parameter for all reflections included in the refinement	1.142
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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