Crystallography Open Database

Information card for entry 7158073

Preview

Coordinates	7158073.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H25 N O4 S
Calculated formula	C31 H25 N O4 S
Title of publication	Palladium-catalyzed stereoselective (3 + 2) cycloaddition of vinylethylene carbonates with cyclic <i>N</i>-sulfonyl ketimines.
Authors of publication	Gao, Xing; Zhu, Dongyu; Jiang, Feng; Liao, Jianning; Wang, Wei; Wu, Yongjun; Zheng, Lufei; Guo, Hongchao
Journal of publication	Organic & biomolecular chemistry
Year of publication	2021
Journal volume	19
Journal issue	22
Pages of publication	4877 - 4881
a	7.6699 ± 0.0015 Å
b	11.185 ± 0.002 Å
c	14.839 ± 0.003 Å
α	97.37 ± 0.03°
β	95.12 ± 0.03°
γ	94.17 ± 0.03°
Cell volume	1252.9 ± 0.4 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153.15 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.061
Residual factor for significantly intense reflections	0.0542
Weighted residual factors for significantly intense reflections	0.1092
Weighted residual factors for all reflections included in the refinement	0.1138
Goodness-of-fit parameter for all reflections included in the refinement	1.081
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
267235 (current)	2021-07-05	cif/ Updating files of 7158073, 7158074, 7158075 Original log message: Adding full bibliography for 7158073--7158075.cif.	7158073.cif
265082	2021-05-11	cif/ Adding structures of 7158073, 7158074, 7158075 via cif-deposit CGI script.	7158073.cif