Crystallography Open Database

Information card for entry 4083971

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Coordinates	4083971.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C88 H122 O Si2 Sn2
Calculated formula	C88 H122 O Si2 Sn2
Title of publication	Structural and Spectroscopic Characterization of Tin‒Tin Double Bonds in Cyclic Distannenes
Authors of publication	Henning, Jens; Eichele, Klaus; Fink, Reinhold F.; Wesemann, Lars
Journal of publication	Organometallics
Year of publication	2014
Journal volume	33
Journal issue	14
Pages of publication	3904
a	13.3504 ± 0.0004 Å
b	17.0668 ± 0.0005 Å
c	18.9247 ± 0.0005 Å
α	77.9082 ± 0.0007°
β	85.583 ± 0.0007°
γ	76.5304 ± 0.0008°
Cell volume	4098.5 ± 0.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0548
Residual factor for significantly intense reflections	0.0335
Weighted residual factors for significantly intense reflections	0.069
Weighted residual factors for all reflections included in the refinement	0.0759
Goodness-of-fit parameter for all reflections included in the refinement	1.009
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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