Crystallography Open Database

Information card for entry 7059526

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Coordinates	7059526.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H20 N6 O2 S4 Zn
Calculated formula	C22 H20 N6 O2 S4 Zn
Title of publication	Synthesis, characterization and bioactivity studies of new dithiocarbazate complexes
Authors of publication	Yekke-ghasemi, Zahra; Ramezani, Mohammad; Mague, Joel T.; Takjoo, Reza
Journal of publication	New Journal of Chemistry
Year of publication	2020
Journal volume	44
Journal issue	21
Pages of publication	8878 - 8889
a	17.0306 ± 0.0006 Å
b	15.5145 ± 0.0006 Å
c	10.2986 ± 0.0004 Å
α	90°
β	113.411 ± 0.002°
γ	90°
Cell volume	2497.1 ± 0.17 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.11
Residual factor for significantly intense reflections	0.0757
Weighted residual factors for significantly intense reflections	0.1783
Weighted residual factors for all reflections included in the refinement	0.2018
Goodness-of-fit parameter for all reflections included in the refinement	1.042
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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