Crystallography Open Database

Information card for entry 7062055

7062054 << 7062055 >> 7062056

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Coordinates	7062055.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H40 Cl4 Fe N2 P2 Pt Se2
Calculated formula	C46 H40 Cl4 Fe N2 P2 Pt 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	23.7129 ± 0.0007 Å
b	10.279 ± 0.0002 Å
c	19.4397 ± 0.0005 Å
α	90°
β	112.458 ± 0.003°
γ	90°
Cell volume	4379 ± 0.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	8
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	0.0404
Residual factor for significantly intense reflections	0.0289
Weighted residual factors for significantly intense reflections	0.063
Weighted residual factors for all reflections included in the refinement	0.066
Goodness-of-fit parameter for all reflections included in the refinement	1.045
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
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.	7062055.cif
279053	2022-11-08	cif/ Adding structures of 7062053, 7062054, 7062055, 7062056, 7062057, 7062058 via cif-deposit CGI script.	7062055.cif