Crystallography Open Database

Information card for entry 4116360

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Coordinates	4116360.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H24 O2 Si2
Calculated formula	C17 H24 O2 Si2
SMILES	[Si](C1=C([Si](C)(C)C)/C(=C/c2ccccc2)OC1=O)(C)(C)C
Title of publication	Reactions of the "Stable" Nitroxyl Radical TEMPO with Ketenes: Formation of a Unique Peroxidic Source of Aminyl Radicals
Authors of publication	Wen-wei Huang; Huda Henry-Riyad; Thomas T. Tidwell
Journal of publication	Journal of the American Chemical Society
Year of publication	1999
Journal volume	121
Pages of publication	3939 - 3943
a	9.3238 ± 0.0004 Å
b	11.4506 ± 0.0004 Å
c	34.2187 ± 0.0013 Å
α	90°
β	90°
γ	90°
Cell volume	3653.3 ± 0.2 Å³
Cell temperature	150 ± 0.1 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0669
Residual factor for significantly intense reflections	0.0434
Weighted residual factors for significantly intense reflections	0.1078
Weighted residual factors for all reflections included in the refinement	0.117
Goodness-of-fit parameter for all reflections included in the refinement	1.045
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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