Crystallography Open Database

Information card for entry 1564971

Preview

Coordinates	1564971.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H20 Cl4 Fe N2 Pd Se
Calculated formula	C17 H20 Cl4 Fe N2 Pd Se
Title of publication	Ferrocenylated Chalcogen (Se and Te)-containing N-heterocyclic carbenes: Selenones, silver and palladium complexes
Authors of publication	Gonzalez, Rodary; Azpiroz, Ramón; Sharma, Pankaj; Villamizar C, Claudia P.; Anzaldo, Bertin; Pérez-Flores, Francisco J.; Toscano, Ruben Alfredo
Journal of publication	Inorganica Chimica Acta
Year of publication	2020
Journal volume	506
Pages of publication	119531
a	19.149 ± 0.0008 Å
b	8.1857 ± 0.0004 Å
c	14.848 ± 0.0005 Å
α	90°
β	112.553 ± 0.002°
γ	90°
Cell volume	2149.41 ± 0.16 Å³
Cell temperature	250 ± 2 K
Ambient diffraction temperature	250 ± 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	0.0746
Residual factor for significantly intense reflections	0.0481
Weighted residual factors for significantly intense reflections	0.0778
Weighted residual factors for all reflections included in the refinement	0.0872
Goodness-of-fit parameter for all reflections included in the refinement	1.183
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
269995 (current)	2021-10-18	cif/ Adding structures of 1564971 via cif-deposit CGI script.	1564971.cif