Crystallography Open Database

Information card for entry 8105043

Preview

Coordinates	8105043.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H20 Cl2 F2 N2 O2 Sn
Calculated formula	C28 H20 Cl2 F2 N2 O2 Sn
SMILES	[Sn]12(OC(=N[N]2=Cc2c(O1)ccc(Cl)c2)c1ccc(Cl)cc1)(Cc1c(F)cccc1)Cc1c(F)cccc1
Title of publication	Crystal structure of (4-chloro-N-[(2-oxido-5-chlorophenyl)methylidene] benzene-carbohydrazonato-κ3N,O,O′)bis(2-fluorobenzyl)tin(IV), C28H20Cl2F2N2O2Sn
Authors of publication	Lee, See Mun; Lo, Kong Mun; Tiekink, Edward R.T.
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2019
Journal volume	235
Journal issue	1
Pages of publication	151 - 153
a	27.8125 ± 0.0004 Å
b	8.4443 ± 0.0002 Å
c	10.7891 ± 0.0001 Å
α	90°
β	91.074 ± 0.001°
γ	90°
Cell volume	2533.45 ± 0.07 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
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	0.0619
Residual factor for significantly intense reflections	0.06
Weighted residual factors for significantly intense reflections	0.1599
Weighted residual factors for all reflections included in the refinement	0.1608
Goodness-of-fit parameter for all reflections included in the refinement	1.166
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
274378 (current)	2022-04-06	cif/ Adding structures of 8105043 via cif-deposit CGI script.	8105043.cif