Crystallography Open Database

Information card for entry 1564129

Preview

Coordinates	1564129.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H18 N4 O2 Sn
Calculated formula	C20 H18 N4 O2 Sn
SMILES	c12ccccc1[N]1=Cc3cc(ccc3O[Sn]1(C)(C)O2)/N=N/c1cnccc1
Title of publication	Synthesis and structural characterization of diorganotin(IV) complexes with heteroditopic pyridyl-ONO′-ligands
Authors of publication	Basu Baul, Tushar S.; Addepalli, Maheswara Rao; Lyčka, Antonin; van Terwingen, Steven; Fátima C. Guedes da Silva, M.
Journal of publication	Inorganica Chimica Acta
Year of publication	2020
Journal volume	512
Pages of publication	119892
a	17.9878 ± 0.0006 Å
b	13.0353 ± 0.0004 Å
c	8.2291 ± 0.0004 Å
α	90°
β	100.304 ± 0.004°
γ	90°
Cell volume	1898.41 ± 0.13 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
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	0.0395
Residual factor for significantly intense reflections	0.0262
Weighted residual factors for significantly intense reflections	0.0631
Weighted residual factors for all reflections included in the refinement	0.0707
Goodness-of-fit parameter for all reflections included in the refinement	1.05
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
267501 (current)	2021-07-13	cif/ Adding structures of 1564129 via cif-deposit CGI script.	1564129.cif