Crystallography Open Database

Information card for entry 7715789

Preview

Coordinates	7715789.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H20 Cl4 N2 O6 Pd2 S2
Calculated formula	C17 H20 Cl4 N2 O6 Pd2 S2
Title of publication	Reactivity of Schiff base-[C,N,S] pincer palladacycles: hydrolysis renders singular trinuclear, tetranuclear, and heteropentanuclear Pd<sub>3</sub>W<sub>2</sub> coordinated complexes.
Authors of publication	Reigosa, Francisco; Polo, Paula M.; Pereira, M. Teresa; Vila, José M
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	23
Pages of publication	9680 - 9691
a	11.6987 ± 0.0006 Å
b	15.0875 ± 0.0008 Å
c	18.3377 ± 0.0009 Å
α	105.262 ± 0.003°
β	104.871 ± 0.003°
γ	107.653 ± 0.004°
Cell volume	2769 ± 0.3 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1213
Residual factor for significantly intense reflections	0.0676
Weighted residual factors for significantly intense reflections	0.1638
Weighted residual factors for all reflections included in the refinement	0.2051
Goodness-of-fit parameter for all reflections included in the refinement	1.0204
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
293127 (current)	2024-07-05	cif/ Updating files of 7715787, 7715788, 7715789, 7715790, 7715791 Original log message: Adding full bibliography for 7715787--7715791.cif.	7715789.cif
291298	2024-04-20	cif/ Adding structures of 7715787, 7715788, 7715789, 7715790, 7715791 via cif-deposit CGI script.	7715789.cif