Crystallography Open Database

Information card for entry 1518323

Preview

Coordinates	1518323.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H21 N3 O2
Calculated formula	C19 H21 N3 O2
SMILES	c1cc2C(=O)N(/N=C(/c3ccccc3O)CC)C(Nc2cc1)(C)C
Title of publication	Versatile coordination behaviour of a multi-dentate Schiff base with manganese(II), copper(II) and zinc(II) ions and their corrosion inhibition study
Authors of publication	Mishra, Monika; Tiwari, Karishma; Singh, Ashish Kumar; Singh, Vinod P.
Journal of publication	Inorganica Chimica Acta
Year of publication	2015
Journal volume	425
Pages of publication	36 - 45
a	26.243 ± 0.011 Å
b	10.56 ± 0.003 Å
c	13.89 ± 0.004 Å
α	90°
β	119.44 ± 0.04°
γ	90°
Cell volume	3352 ± 2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
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	0.1709
Residual factor for significantly intense reflections	0.0582
Weighted residual factors for significantly intense reflections	0.1023
Weighted residual factors for all reflections included in the refinement	0.1615
Goodness-of-fit parameter for all reflections included in the refinement	0.91
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
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1518323.cif
127932	2014-11-27	cif/ Adding structures of 1518322, 1518323, 1518324, 1518325, 1518326 via cif-deposit CGI script.	1518323.cif