Crystallography Open Database

Information card for entry 4345763

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Coordinates	4345763.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	I12.73 W6
Calculated formula	I12.737 W6
Title of publication	A Reaction Cycle for Octahedral Tungsten Iodide Clusters.
Authors of publication	Ströbele, Markus; Meyer, Hans-Jürgen
Journal of publication	Inorganic chemistry
Year of publication	2017
Journal volume	56
Journal issue	10
Pages of publication	5880 - 5884
a	9.9618 ± 0.001 Å
b	10.9049 ± 0.0008 Å
c	13.0586 ± 0.001 Å
α	89.997 ± 0.006°
β	106.695 ± 0.007°
γ	98.77 ± 0.007°
Cell volume	1341.5 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	2
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.071
Residual factor for significantly intense reflections	0.0384
Weighted residual factors for significantly intense reflections	0.0684
Weighted residual factors for all reflections included in the refinement	0.077
Goodness-of-fit parameter for all reflections included in the refinement	0.985
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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