Crystallography Open Database

Information card for entry 4028572

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Coordinates	4028572.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H56 N4 O10 Si
Calculated formula	C41 H56 N4 O10 Si
Title of publication	Enantioselective Total Syntheses of Plectosphaeroic Acids B and C
Authors of publication	Salman Y. Jabri; Larry E. Overman
Journal of publication	Journal of Organic Chemistry
Year of publication	2013
Journal volume	78
Pages of publication	8766 - 8788
a	13.9515 ± 0.0006 Å
b	7.4841 ± 0.0003 Å
c	20.7748 ± 0.0009 Å
α	90°
β	98.7267 ± 0.0005°
γ	90°
Cell volume	2144.08 ± 0.16 Å³
Cell temperature	83 ± 2 K
Ambient diffraction temperature	83 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.037
Residual factor for significantly intense reflections	0.0358
Weighted residual factors for significantly intense reflections	0.0983
Weighted residual factors for all reflections included in the refinement	0.0993
Goodness-of-fit parameter for all reflections included in the refinement	1.048
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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