Crystallography Open Database

Information card for entry 7062056

7062055 << 7062056 >> 7062057

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Coordinates	7062056.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C167 H135 Cl15 F18 Fe4 N4 O18 P8 Pt4 S6 Se4
Calculated formula	C164 H132 Cl12 F12 Fe4 N4 O12 P8 Pt4 S4 Se4
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	20.2575 ± 0.0003 Å
b	20.2575 ± 0.0003 Å
c	47.4558 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	19474.3 ± 0.6 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	11
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.051
Residual factor for significantly intense reflections	0.0328
Weighted residual factors for significantly intense reflections	0.0849
Weighted residual factors for all reflections included in the refinement	0.0937
Goodness-of-fit parameter for all reflections included in the refinement	0.848
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

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