Crystallography Open Database

Information card for entry 7708828

Preview

Coordinates	7708828.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H59 N O4
Calculated formula	C41 H59 N O4
Title of publication	Amino acid-derived bisphenolate palladium complexes as C-C coupling catalysts
Authors of publication	Fazekas, Eszter; Jenkins, David T.; Forbes, Andrew A.; Gallagher, Brendan; Rosair, Georgina; McIntosh, Ruaraidh D.
Journal of publication	Dalton Transactions
Year of publication	2021
a	10.4115 ± 0.0002 Å
b	11.7529 ± 0.0002 Å
c	31.8349 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	3895.49 ± 0.12 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 K
Number of distinct elements	4
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	0.0583
Residual factor for significantly intense reflections	0.0567
Weighted residual factors for significantly intense reflections	0.1615
Weighted residual factors for all reflections included in the refinement	0.1632
Goodness-of-fit parameter for all reflections included in the refinement	1.087
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
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/7708828.html