Crystallography Open Database

Information card for entry 4115466

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Coordinates	4115466.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C98 H80 As3 La O9
Calculated formula	C101 H68 As3 La O11
Title of publication	Catalytic Asymmetric Epoxidation of Enones Using La-BINOL-Triphenylarsine Oxide Complex: Structural Determination of the Asymmetric Catalyst
Authors of publication	Tetsuhiro Nemoto; Takashi Ohshima; Kentaro Yamaguchi; Masakatsu Shibasaki
Journal of publication	Journal of the American Chemical Society
Year of publication	2001
Journal volume	123
Pages of publication	2725 - 2732
a	17.6048 ± 0.0006 Å
b	17.6048 ± 0.0006 Å
c	26.653 ± 0.001 Å
α	90°
β	90°
γ	120°
Cell volume	7153.8 ± 0.4 Å³
Cell temperature	173.2 K
Number of distinct elements	5
Space group number	152
Hermann-Mauguin space group symbol	P 31 2 1
Hall space group symbol	P 31 2"
Residual factor for significantly intense reflections	0.0544
Weighted residual factors for all reflections included in the refinement	0.082
Goodness-of-fit parameter for all reflections included in the refinement	1.845
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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