Crystallography Open Database

Information card for entry 4069396

Preview

Coordinates	4069396.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H44 N2 O4 Si4 Sn3
Calculated formula	C24 H44 N2 O4 Si4 Sn3
SMILES	[Sn]123[O]4[Sn](N([Si](C)(C)C)[Si](C)(C)C)[O]2c2c([O]1[Sn]([O]3c1c4cccc1)N([Si](C)(C)C)[Si](C)(C)C)cccc2
Title of publication	N,S- and N,O-Substituted Stannylenes: Preparation and X-ray Diffraction Studies
Authors of publication	Zabula, Alexander V.; Pape, Tania; Hupka, Florian; Hepp, Alexander; Hahn, F. Ekkehardt
Journal of publication	Organometallics
Year of publication	2009
Journal volume	28
Journal issue	14
Pages of publication	4221
a	12.6118 ± 0.0004 Å
b	16.8354 ± 0.0005 Å
c	17.5351 ± 0.0005 Å
α	106.06 ± 0.001°
β	90.564 ± 0.001°
γ	100.265 ± 0.001°
Cell volume	3513.67 ± 0.18 Å³
Cell temperature	153 ± 1 K
Ambient diffraction temperature	153 ± 1 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0355
Residual factor for significantly intense reflections	0.0272
Weighted residual factors for significantly intense reflections	0.0563
Weighted residual factors for all reflections included in the refinement	0.0591
Goodness-of-fit parameter for all reflections included in the refinement	1.029
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
178582 (current)	2016-03-21	cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/93.	4069396.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4069396.cif
40278	2012-03-07	../uploads/cif-deposit/cod/cif Adding structures of 4069396 via cif-deposit CGI script.	4069396.cif