Crystallography Open Database

Information card for entry 7063520

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Coordinates	7063520.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H26 N2 O5 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	11.276 ± 0.0006 Å
b	17.4923 ± 0.0009 Å
c	15.1911 ± 0.001 Å
α	90°
β	109.384 ± 0.007°
γ	90°
Cell volume	2826.5 ± 0.3 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/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0806
Residual factor for significantly intense reflections	0.0508
Weighted residual factors for significantly intense reflections	0.1398
Weighted residual factors for all reflections included in the refinement	0.1561
Goodness-of-fit parameter for all reflections included in the refinement	1.0321
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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