Crystallography Open Database

Information card for entry 4109526

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Coordinates	4109526.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C61 H88 N4 O2 Si2
Calculated formula	C61 H88 N4 O2 Si2
Title of publication	An Isolable Silanoic Ester by Oxygenation of a Stable Silylene
Authors of publication	Shenglai Yao; Yun Xiong; Markus Brym
Journal of publication	Journal of the American Chemical Society
Year of publication	2007
Journal volume	129
Pages of publication	7268 - 7269
a	11.967 ± 0.003 Å
b	12.44 ± 0.003 Å
c	21.006 ± 0.002 Å
α	78.249 ± 0.013°
β	75.127 ± 0.015°
γ	69.87 ± 0.02°
Cell volume	2814.8 ± 1.1 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.0989
Residual factor for significantly intense reflections	0.0542
Weighted residual factors for significantly intense reflections	0.1243
Weighted residual factors for all reflections included in the refinement	0.1386
Goodness-of-fit parameter for all reflections included in the refinement	0.989
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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