Crystallography Open Database

Information card for entry 7061621

Preview

Coordinates	7061621.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	cis-bis(N,N'-dimethylimidazole)dichloroplatinum(II)
Formula	C10 H16 Cl2 N4 Pt
Calculated formula	C10 H16 Cl2 N4 Pt
SMILES	[Pt](Cl)(Cl)(=C1N(C=CN1C)C)=C1N(C=CN1C)C
Title of publication	Cis and trans platinum(II) N-heterocyclic carbene isomers: synthesis, characterization and biological activity
Authors of publication	Rivera, Carolina; Bacilio-Beltrán, Héctor Alejandro; Puebla-Pérez, Ana Maria; Rangel-Salas, Irma Idalia; Alvarado–Rodríguez, José G; Flores-Moreno, Roberto; Velázquez- Juárez, Gilberto; Peregrina-Lucano, Alejandro Aarón; Becerra-Martinez, Elvia; Valdez-Ruvalcaba, Jaime; Rubio-Garcia, J. Emiliano; Cortes-Llamas, Sara Angelica
Journal of publication	New Journal of Chemistry
Year of publication	2022
a	15.1567 ± 0.0004 Å
b	10.5298 ± 0.0003 Å
c	8.732 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	1393.6 ± 0.06 Å³
Cell temperature	294.15 K
Ambient diffraction temperature	294.15 K
Number of distinct elements	5
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0167
Residual factor for significantly intense reflections	0.0149
Weighted residual factors for significantly intense reflections	0.035
Weighted residual factors for all reflections included in the refinement	0.0362
Goodness-of-fit parameter for all reflections included in the refinement	1.068
Diffraction radiation probe	x-ray
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
276304 (current)	2022-06-28	cif/ Adding structures of 7061621, 7061622 via cif-deposit CGI script.	7061621.cif