Crystallography Open Database

Information card for entry 2238894

Preview

Coordinates	2238894.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	{4-Chloro-<i>N</i>'-[(2-oxidonaphthalen-1-yl-κ<i>O</i>)methylidene]benzohydrazidato-κ^2^<i>N</i>',<i>O</i>}dimethyltin(IV)
Formula	C20 H17 Cl N2 O2 Sn
Calculated formula	C20 H17 Cl N2 O2 Sn
SMILES	[Sn]12(OC(=N[N]2=Cc2c(O1)ccc1ccccc21)c1ccc(cc1)Cl)(C)C
Title of publication	{4-Chloro-<i>N</i>'-[(2-oxidonaphthalen-1-yl-κ<i>O</i>)methylidene]benzohydrazidato-κ^2^<i>N</i>',<i>O</i>}dimethyltin(IV)
Authors of publication	Cui, Jichun; Qiao, Yanling; Wang, Fei
Journal of publication	Acta Crystallographica Section E
Year of publication	2013
Journal volume	69
Journal issue	12
Pages of publication	m688
a	8.7927 ± 0.0008 Å
b	17.417 ± 0.0015 Å
c	12.5014 ± 0.0012 Å
α	90°
β	98.69 ± 0.009°
γ	90°
Cell volume	1892.5 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.0577
Residual factor for significantly intense reflections	0.0397
Weighted residual factors for significantly intense reflections	0.0929
Weighted residual factors for all reflections included in the refinement	0.1074
Goodness-of-fit parameter for all reflections included in the refinement	1.06
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
176798 (current)	2016-02-21	cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23.	2238894.cif
92266	2014-01-12	cif/ Adding structures of 2238894 via cif-deposit CGI script.	2238894.cif