Crystallography Open Database

Information card for entry 4115646

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Coordinates	4115646.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H41 K O6 Si
Calculated formula	C30 H43 K O6 Si
Title of publication	The First Structurally Characterized Hypervalent Silicon Hydride: Unexpected Molecular Geometry and Si-H...K Interactions
Authors of publication	Michael J. Bearpark; G. Sean McGrady; Paul D. Prince; Jonathan W. Steed
Journal of publication	Journal of the American Chemical Society
Year of publication	2001
Journal volume	123
Pages of publication	7736 - 7737
a	9.4424 ± 0.0015 Å
b	9.4424 ± 0.0015 Å
c	9.4424 ± 0.0015 Å
α	97.93 ± 0.01°
β	97.93 ± 0.01°
γ	97.93 ± 0.01°
Cell volume	815.2 ± 0.2 Å³
Cell temperature	393 ± 2 K
Ambient diffraction temperature	393 ± 2 K
Number of distinct elements	5
Space group number	146
Hermann-Mauguin space group symbol	R 3 :R
Hall space group symbol	P 3*
Residual factor for all reflections	0.0862
Residual factor for significantly intense reflections	0.0462
Weighted residual factors for significantly intense reflections	0.079
Weighted residual factors for all reflections included in the refinement	0.0933
Goodness-of-fit parameter for all reflections included in the refinement	1.024
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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