Crystallography Open Database

Information card for entry 7036774

Preview

Coordinates	7036774.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cl8 H100 K14.5 Li17.5 O234 P8 Sn8 W48
Calculated formula	Cl8 K14.5 O219.08 P8 Sn8 W48
Title of publication	Tin(ii)-functionalization of the archetypal {P8W48} polyoxotungstate.
Authors of publication	Izarova, N. V.; Klaß, L; de Oliveira, P.; Mbomekalle, I.-M.; Peters, V.; Haarmann, F.; Kögerler, P
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	44
Pages of publication	19200 - 19206
a	25.4151 ± 0.0003 Å
b	25.4151 ± 0.0003 Å
c	21.7748 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	14064.9 ± 0.3 Å³
Cell temperature	120 ± 0.1 K
Ambient diffraction temperature	120 ± 0.1 K
Number of distinct elements	8
Space group number	87
Hermann-Mauguin space group symbol	I 4/m
Hall space group symbol	-I 4
Residual factor for all reflections	0.0709
Residual factor for significantly intense reflections	0.0583
Weighted residual factors for significantly intense reflections	0.1563
Weighted residual factors for all reflections included in the refinement	0.1691
Goodness-of-fit parameter for all reflections included in the refinement	1.092
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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