Crystallography Open Database

Information card for entry 1570779

Preview

Coordinates	1570779.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	<i>trans</i>-Dichloridobis[(<i>S</i>)-(–)-1-(4-methylphenyl)ethylamine-κ<i>N</i>]palladium(II)
Formula	C18 H26 Cl2 N2 Pd
Calculated formula	C18 H26 Cl2 N2 Pd
SMILES	[Pd](Cl)(Cl)([NH2][C@H](c1ccc(cc1)C)C)[NH2][C@H](c1ccc(cc1)C)C
Title of publication	trans-Dichloridobis[(S)-(−)-1-(4-methylphenyl)ethylamine-κN]palladium(II)
Authors of publication	Hernández Téllez, Guadalupe; Moreno Morales, Gloria E.; Sharma, Pankaj; Gonzalez, Rodary; Anzaldo, Bertin
Journal of publication	IUCrData
Year of publication	2024
Journal volume	9
Journal issue	1
Pages of publication	x240036
a	6.5385 ± 0.0002 Å
b	16.7263 ± 0.0008 Å
c	19.0096 ± 0.0011 Å
α	90°
β	90°
γ	90°
Cell volume	2078.98 ± 0.17 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
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	0.0798
Residual factor for significantly intense reflections	0.0492
Weighted residual factors for significantly intense reflections	0.0851
Weighted residual factors for all reflections included in the refinement	0.0954
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
300370 (current)	2025-07-05	Updating bibliography information from the data sent by Robert McMeeking. cod/ (saulius@pterodaktilis)	1570779.cif
289080	2024-01-13	cif/ Adding structures of 1570779 via cif-deposit CGI script.	1570779.cif