Crystallography Open Database

Information card for entry 2019262

2019261 << 2019262 >> 2019263

Preview

Coordinates	2019262.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Chlorido{μ-2-[(2-oxidobenzylidene)amino]ethan-1-olato-κ^4^<i>O</i>,<i>N</i>,<i>O</i>':<i>O</i>'}{2-[(2-oxidobenzylidene)amino]ethan-1-olato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>'}trivinylditin(IV)
Formula	C24 H27 Cl N2 O4 Sn2
Calculated formula	C24 H27 Cl N2 O4 Sn2
SMILES	[Sn]12([O]([Sn]34(Cl)(OCC[N]4=Cc4c(O3)cccc4)C=C)CC[N]2=Cc2c(O1)cccc2)(C=C)C=C
Title of publication	Enantiotropic phase transition in a binuclear tin complex with an <i>O</i>,<i>N</i>,<i>O</i>'-tridentate ligand
Authors of publication	Schwarzer, Anke; Paul, Lydia E. H.; Böhme, Uwe
Journal of publication	Acta Crystallographica Section C
Year of publication	2013
Journal volume	69
Journal issue	11
Pages of publication	1336 - 1339
a	13.2848 ± 0.0003 Å
b	15.7966 ± 0.0004 Å
c	25.7287 ± 0.0006 Å
α	90°
β	109.176 ± 0.001°
γ	90°
Cell volume	5099.7 ± 0.2 Å³
Cell temperature	93 ± 2 K
Ambient diffraction temperature	93 ± 2 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	0.0479
Residual factor for significantly intense reflections	0.0327
Weighted residual factors for significantly intense reflections	0.0611
Weighted residual factors for all reflections included in the refinement	0.0658
Goodness-of-fit parameter for all reflections included in the refinement	1.091
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
176760 (current)	2016-02-20	cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01.	2019262.cif
91249	2013-12-09	cif/ Adding structures of 2019261, 2019262 via cif-deposit CGI script.	2019262.cif