Crystallography Open Database

Information card for entry 4133164

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Coordinates	4133164.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C43.75 H77 Cr I2 N2 O8 Si2
Calculated formula	C43.75 H77 Cr I2 N2 O8 Si2
Title of publication	Unveiling the Takai Olefination Reagent via Tris( tert-butoxy)siloxy Variants.
Authors of publication	Werner, Daniel; Anwander, Reiner
Journal of publication	Journal of the American Chemical Society
Year of publication	2018
Journal volume	140
Journal issue	43
Pages of publication	14334 - 14341
a	27.7924 ± 0.0018 Å
b	9.4487 ± 0.0006 Å
c	42.685 ± 0.003 Å
α	90°
β	101.37 ± 0.001°
γ	90°
Cell volume	10989.2 ± 1.3 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	7
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	0.0567
Residual factor for significantly intense reflections	0.0456
Weighted residual factors for significantly intense reflections	0.1117
Weighted residual factors for all reflections included in the refinement	0.1216
Goodness-of-fit parameter for all reflections included in the refinement	1.194
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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