Crystallography Open Database

Information card for entry 7157336

Preview

Coordinates	7157336.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H34 B Cl2 Co F4 N P S
Calculated formula	C31 H34 B Cl2 Co F4 N P S
Title of publication	Cobalt-catalyzed regioselective hydrohydrazination of epoxides.
Authors of publication	Liu, Xiangyu; Song, Heng; Zhai, Xiaofang; Tung, Chen-Ho; Wang, Wenguang
Journal of publication	Organic & biomolecular chemistry
Year of publication	2020
Journal volume	18
Journal issue	8
Pages of publication	1572 - 1576
a	18.0169 ± 0.0004 Å
b	19.1954 ± 0.0005 Å
c	9.2687 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	3205.5 ± 0.13 Å³
Cell temperature	173 ± 0.1 K
Ambient diffraction temperature	173 ± 0.1 K
Number of distinct elements	9
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0608
Residual factor for significantly intense reflections	0.052
Weighted residual factors for significantly intense reflections	0.1146
Weighted residual factors for all reflections included in the refinement	0.1241
Goodness-of-fit parameter for all reflections included in the refinement	1.107
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
249024 (current)	2020-03-05	cif/ Updating files of 7157336, 7157337, 7157338 Original log message: Adding full bibliography for 7157336--7157338.cif.	7157336.cif
247540	2020-02-04	cif/ Adding structures of 7157336, 7157337, 7157338 via cif-deposit CGI script.	7157336.cif