Crystallography Open Database

Information card for entry 1563997

Preview

Coordinates	1563997.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H19 N3 O4 S
Calculated formula	C20 H19 N3 O4 S
SMILES	c1(cccc[nH]1)=NS(=O)(=O)c1ccc(cc1)/N=C/c1cccc(c1O)OCC
Title of publication	Spectroscopic investigation, fluorescence quenching, in vitro antibacterial and cytotoxicity assay of Co(II) and Ni(II) complexes containing 4-((3-ethoxy-2-hydroxy benzylidene)amino)-N-(pyridin-2-yl)benzenesulfonamide
Authors of publication	Gomathi, V.; Selvameena, R.
Journal of publication	Inorganica Chimica Acta
Year of publication	2018
Journal volume	480
Pages of publication	42 - 46
a	8.0754 ± 0.0003 Å
b	8.35 ± 0.0003 Å
c	15.2691 ± 0.0005 Å
α	92.661 ± 0.002°
β	99.537 ± 0.002°
γ	111.426 ± 0.002°
Cell volume	938.75 ± 0.06 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0418
Residual factor for significantly intense reflections	0.0351
Weighted residual factors for significantly intense reflections	0.0912
Weighted residual factors for all reflections included in the refinement	0.0985
Goodness-of-fit parameter for all reflections included in the refinement	1.051
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
267322 (current)	2021-07-07	cif/ Adding structures of 1563997 via cif-deposit CGI script.	1563997.cif