Crystallography Open Database

Information card for entry 1564473

Preview

Coordinates	1564473.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H25.45 Cl1.708 I0.292 N4 O0.727 Pt
Calculated formula	C18 H25.454 Cl1.708 I0.292 N4 O0.727 Pt
Title of publication	Mn(III), Zn(II) and Pt(II) macroacyclic complexes: Synthesis, X-ray structures, anticancer and antioxidant activities
Authors of publication	Keypour, Hassan; Ansari, Neda; Mahmoudabadi, Masoumeh; Karamian, Roya; Moazzami Farida, Seyed Hamed; Eslami Moghadam, Mahboube; William Gable, Robert
Journal of publication	Inorganica Chimica Acta
Year of publication	2020
Journal volume	509
Pages of publication	119705
a	8.1878 ± 0.0003 Å
b	27.6088 ± 0.001 Å
c	9.0472 ± 0.0003 Å
α	90°
β	105.741 ± 0.004°
γ	90°
Cell volume	1968.47 ± 0.13 Å³
Cell temperature	100.2 ± 0.3 K
Ambient diffraction temperature	100.2 ± 0.3 K
Number of distinct elements	7
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.023
Residual factor for significantly intense reflections	0.0222
Weighted residual factors for significantly intense reflections	0.0542
Weighted residual factors for all reflections included in the refinement	0.0549
Goodness-of-fit parameter for all reflections included in the refinement	1.023
Diffraction radiation probe	x-ray
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
268317 (current)	2021-08-31	cif/ Adding structures of 1564473 via cif-deposit CGI script.	1564473.cif