Crystallography Open Database

Information card for entry 4134753

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Coordinates	4134753.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H58 O3 Si2
Calculated formula	C33 H58 O3 Si2
Title of publication	Asymmetric Total Synthesis of (-)-Spirochensilide A.
Authors of publication	Liang, Xin-Ting; Chen, Jia-Hua; Yang, Zhen
Journal of publication	Journal of the American Chemical Society
Year of publication	2020
a	7.3602 ± 0.0005 Å
b	17.1118 ± 0.0011 Å
c	26.8552 ± 0.0016 Å
α	93.828 ± 0.005°
β	96.178 ± 0.005°
γ	92.265 ± 0.005°
Cell volume	3351.4 ± 0.4 Å³
Cell temperature	106.4 K
Ambient diffraction temperature	106.4 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1769
Residual factor for significantly intense reflections	0.0824
Weighted residual factors for significantly intense reflections	0.114
Weighted residual factors for all reflections included in the refinement	0.147
Goodness-of-fit parameter for all reflections included in the refinement	0.99
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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