Crystallography Open Database

Information card for entry 1575050

Preview

Coordinates	1575050.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H33 N O5 S
Calculated formula	C30 H33 N O5 S
Title of publication	Palladium-catalyzed redox diversified entry to axially chiral styrenes <i>via</i> asymmetric olefination with alkynes.
Authors of publication	Lin, Ziwei; Jiang, Yuqing; Wang, Fen; Huang, Genping; Li, Jessica; Li, Xingwei
Journal of publication	Chemical science
Year of publication	2025
Journal volume	16
Journal issue	31
Pages of publication	14252 - 14261
a	10.0206 ± 0.0009 Å
b	15.6245 ± 0.0014 Å
c	17.2804 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	2705.5 ± 0.4 Å³
Cell temperature	183 K
Ambient diffraction temperature	183 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0325
Residual factor for significantly intense reflections	0.0318
Weighted residual factors for significantly intense reflections	0.0867
Weighted residual factors for all reflections included in the refinement	0.0874
Goodness-of-fit parameter for all reflections included in the refinement	1.0479
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
302512 (current)	2025-10-06	cif/ Updating files of 1575048, 1575049, 1575050 Original log message: Adding full bibliography for 1575048--1575050.cif.	1575050.cif
300351	2025-07-05	cif/ Adding structures of 1575048, 1575049, 1575050 via cif-deposit CGI script.	1575050.cif