Crystallography Open Database

Information card for entry 1568402

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Coordinates	1568402.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9 H16 Cl N3 O2 S
Calculated formula	C9 H16 Cl N3 O2 S
Title of publication	Synthesis, Characterization and Antiproliferative Evaluation of Pt(II) and Pd(II) Complexes with a Thiazine-Pyridine Derivative Ligand
Authors of publication	Silvia Gutiérrez-Tarriño; Javier Espino; Francisco Luna-Giles; Ana B. Rodríguez; Jos'e A. Pariente; Emilio Viñuelas-Zahínos
Journal of publication	Pharmaceuticals
Year of publication	2021
Journal volume	14
Pages of publication	395
a	6.968 Å
b	9.577 Å
c	9.593 Å
α	96°
β	97.83°
γ	101.18°
Cell volume	616.489 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0502
Residual factor for significantly intense reflections	0.0422
Weighted residual factors for significantly intense reflections	0.1246
Weighted residual factors for all reflections included in the refinement	0.1295
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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