Crystallography Open Database

Information card for entry 7715760

Preview

Coordinates	7715760.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H19 Br N2 O2 Pd S
Calculated formula	C19 H19 Br N2 O2 Pd S
Title of publication	Unveiling the promising anticancer activity of palladium(II)-aryl complexes bearing diphosphine ligands: a structure-activity relationship analysis
Authors of publication	Tonon, Giovanni; Mauceri, Matteo; Cavarzerani, Enrico; Piccolo, Rachele; Santo, Claudio; Demitri, Nicola; Orian, Laura; Nogara, Pablo Andrei; Teixeira Rocha, Joao Batista; Canzonieri, Vincenzo; Rizzolio, Flavio; Visentin, Fabiano; Scattolin, Thomas
Journal of publication	Dalton Transactions
Year of publication	2024
a	10.774 ± 0.002 Å
b	15.515 ± 0.003 Å
c	11.805 ± 0.002 Å
α	90°
β	95.72 ± 0.03°
γ	90°
Cell volume	1963.5 ± 0.6 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.035
Residual factor for significantly intense reflections	0.0313
Weighted residual factors for significantly intense reflections	0.0861
Weighted residual factors for all reflections included in the refinement	0.0894
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation wavelength	0.62 Å
Diffraction radiation type	Synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
291265 (current)	2024-04-18	cif/ Adding structures of 7715758, 7715759, 7715760, 7715761, 7715762, 7715763 via cif-deposit CGI script.	7715760.cif