Crystallography Open Database

Information card for entry 7132768

Preview

Coordinates	7132768.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H18 Cl3 N O2
Calculated formula	C23 H18 Cl3 N O2
Title of publication	Palladium-catalyzed enantioselective arylation of trichloro- or tri-/difluoroacetaldimine precursors.
Authors of publication	Wei, Jian; Du, Zhongjian; Wang, Xu; Ji, Chenlei; Li, Longji; You, Yang'en
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2024
Journal volume	60
Journal issue	24
Pages of publication	3303 - 3306
a	5.5787 ± 0.0005 Å
b	13.2751 ± 0.0009 Å
c	27.4431 ± 0.0018 Å
α	90°
β	90°
γ	90°
Cell volume	2032.4 ± 0.3 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 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	0.0527
Residual factor for significantly intense reflections	0.0402
Weighted residual factors for significantly intense reflections	0.0711
Weighted residual factors for all reflections included in the refinement	0.0775
Goodness-of-fit parameter for all reflections included in the refinement	1.084
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7132768.html