Crystallography Open Database

Information card for entry 4020161

4020160 << 4020161 >> 4020162

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Coordinates	4020161.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H60 N O4.5 S Si2
Calculated formula	C32 H60 N O4.5 S Si2
Authors of publication	Kathryn Hassall; Sofia Lobachevsky; Jonathan M. White
Journal of publication	Journal of Organic Chemistry
Year of publication	2005
Journal volume	70
Pages of publication	1993 - 1997
a	30.727 ± 0.004 Å
b	8.2906 ± 0.001 Å
c	29.838 ± 0.004 Å
α	90°
β	104.767 ± 0.002°
γ	90°
Cell volume	7350 ± 1.5 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0854
Residual factor for significantly intense reflections	0.0491
Weighted residual factors for significantly intense reflections	0.0908
Weighted residual factors for all reflections included in the refinement	0.0987
Goodness-of-fit parameter for all reflections included in the refinement	0.854
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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