Crystallography Open Database

Information card for entry 7063519

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Coordinates	7063519.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H22 N2 O4 S2 Zn
Calculated formula	C26 H22 N2 O4 S2 Zn
Title of publication	Synthesis, characterization, and biological applications of zinc(ii) complexes of the methylthiosalicylate ligand
Authors of publication	Pratap, Rajesh; Kumari, Soni; Chaturvedi, Nishtha; Mishra, Rajnikant; Bhattacharya, Subrato
Journal of publication	New Journal of Chemistry
Year of publication	2024
Journal volume	48
Journal issue	47
Pages of publication	19763 - 19778
a	12.9159 ± 0.0002 Å
b	13.4516 ± 0.0002 Å
c	14.7014 ± 0.0002 Å
α	90°
β	106.134 ± 0.002°
γ	90°
Cell volume	2453.61 ± 0.07 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	6
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	0.0476
Residual factor for significantly intense reflections	0.0309
Weighted residual factors for significantly intense reflections	0.0718
Weighted residual factors for all reflections included in the refinement	0.0772
Goodness-of-fit parameter for all reflections included in the refinement	1.0349
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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