Crystallography Open Database

Information card for entry 4074203

Preview

Coordinates	4074203.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Tetrakis-(2,4-dimethyl-phenyl)stannane
Formula	C32 H36 Sn
Calculated formula	C32 H36 Sn
SMILES	[Sn](c1c(cc(cc1)C)C)(c1c(cc(cc1)C)C)(c1c(cc(cc1)C)C)c1c(cc(cc1)C)C
Title of publication	The Ullmann Coupling Reaction: A New Approach to Tetraarylstannanes
Authors of publication	Shaikh, Nadim S.; Parkin, Sean; Lehmler, Hans-Joachim
Journal of publication	Organometallics
Year of publication	2006
Journal volume	25
Journal issue	17
Pages of publication	4207
a	10.9038 ± 0.0001 Å
b	12.0001 ± 0.0001 Å
c	12.4461 ± 0.0001 Å
α	66.4013 ± 0.0004°
β	69.3562 ± 0.0004°
γ	70.6943 ± 0.0004°
Cell volume	1362 ± 0.02 Å³
Cell temperature	90 ± 0.2 K
Ambient diffraction temperature	90 ± 0.2 K
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0263
Residual factor for significantly intense reflections	0.0225
Weighted residual factors for significantly intense reflections	0.0517
Weighted residual factors for all reflections included in the refinement	0.0536
Goodness-of-fit parameter for all reflections included in the refinement	1.067
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
178631 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/42.	4074203.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4074203.cif
48247	2012-03-26	../uploads/cif-deposit/cod/cif Adding structures of 4074200, 4074201, 4074202, 4074203 via cif-deposit CGI script.	4074203.cif