Crystallography Open Database

Information card for entry 7062058

7062057 << 7062058 >> 7062059

Preview

Coordinates	7062058.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C81 H66 Cl2 F6 Fe2 N2 O6 P4 Pt2 S2 Se2
Calculated formula	C81 H66 Cl2 F6 Fe2 N2 O6 P4 Pt2 S2 Se2
Title of publication	Anticancer activity of Pt-selenolate metallacycles
Authors of publication	Pal, M. K.; Majumdar, A. G.; Vivekananda, K. V.; Wadawale, A. P.; Subramanian, M.; Bhuvanesh, N.; Dey, S.
Journal of publication	New Journal of Chemistry
Year of publication	2022
Journal volume	46
Journal issue	48
Pages of publication	23198 - 23212
a	12.8799 ± 0.0002 Å
b	16.5012 ± 0.0003 Å
c	38.1414 ± 0.0005 Å
α	90°
β	98.275 ± 0.001°
γ	90°
Cell volume	8021.9 ± 0.2 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	11
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	0.0601
Residual factor for significantly intense reflections	0.0412
Weighted residual factors for significantly intense reflections	0.0932
Weighted residual factors for all reflections included in the refinement	0.1019
Goodness-of-fit parameter for all reflections included in the refinement	1.054
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
280203 (current)	2023-01-06	cif/ Updating files of 7062053, 7062054, 7062055, 7062056, 7062057, 7062058 Original log message: Adding full bibliography for 7062053--7062058.cif.	7062058.cif
279053	2022-11-08	cif/ Adding structures of 7062053, 7062054, 7062055, 7062056, 7062057, 7062058 via cif-deposit CGI script.	7062058.cif