Crystallography Open Database

Information card for entry 7063551

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Coordinates	7063551.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H14 O4 S4 Zn
Calculated formula	C16 H14 O4 S4 Zn
Title of publication	Anti-leishmanial study of discrete tetrahedral zinc(ii) β-oxodithioester complexes
Authors of publication	Yadav, Chote Lal; Anamika,; Singh, Rajan; Kumar, Akhilesh; Singh, Rakesh K.; Drew, Michael G. B.; Manar, Krishna K.; Singh, Nanhai
Journal of publication	New Journal of Chemistry
Year of publication	2025
Journal volume	49
Journal issue	2
Pages of publication	484 - 496
a	24.5268 ± 0.0014 Å
b	4.7097 ± 0.0003 Å
c	16.8095 ± 0.0009 Å
α	90°
β	110.665 ± 0.003°
γ	90°
Cell volume	1816.8 ± 0.19 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
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	0.0443
Residual factor for significantly intense reflections	0.0363
Weighted residual factors for significantly intense reflections	0.0833
Weighted residual factors for all reflections included in the refinement	0.088
Goodness-of-fit parameter for all reflections included in the refinement	1.072
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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