Crystallography Open Database

Information card for entry 7132610

Preview

Coordinates	7132610.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49 H41 F3 O4 P2 Pd S
Calculated formula	C49 H42 F3 O4 P2 Pd S
Title of publication	Palladium-catalyzed allylation and carbonylation: access to allylhydrazones and allyl acylhydrazones.
Authors of publication	Liang, Qianqian; Cai, Yan; Jiang, Wenjun; Pang, Mengdi; Fan, Liming; Zhang, Guoying
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2024
Journal volume	60
Journal issue	12
Pages of publication	1638 - 1641
a	9.2641 ± 0.0011 Å
b	18.7713 ± 0.0017 Å
c	12.8967 ± 0.0012 Å
α	90°
β	101.38 ± 0.003°
γ	90°
Cell volume	2198.6 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.1392
Residual factor for significantly intense reflections	0.0785
Weighted residual factors for significantly intense reflections	0.1853
Weighted residual factors for all reflections included in the refinement	0.212
Goodness-of-fit parameter for all reflections included in the refinement	1.065
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7132610.html