Crystallography Open Database

Information card for entry 7063550

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Coordinates	7063550.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H16 Br2 O2 S4 Zn
Calculated formula	C20 H16 Br2 O2 S4 Zn
Title of publication	Anti-leishmanial Study of Discrete Tetrahedral Zinc(II) β-oxodithioester Complexes
Authors of publication	Yadav, Chote Lal; Kushwaha, Anamika; Singh, Rajan; Kumar, Akhilesh; Singh, Rakesh; Drew, Michael G. B.; Manar, Krishna Kumar; Singh, Nanhai
Journal of publication	New Journal of Chemistry
Year of publication	2024
a	17.3013 ± 0.0015 Å
b	4.7563 ± 0.0004 Å
c	26.838 ± 0.002 Å
α	90°
β	98.01 ± 0.004°
γ	90°
Cell volume	2187 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0932
Residual factor for significantly intense reflections	0.048
Weighted residual factors for significantly intense reflections	0.0814
Weighted residual factors for all reflections included in the refinement	0.0934
Goodness-of-fit parameter for all reflections included in the refinement	1.03
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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