Crystallography Open Database

Information card for entry 7026054

Preview

Coordinates	7026054.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H20 Sn
Calculated formula	C12 H20 Sn
SMILES	[Sn](c1c(cc(cc1C)C)C)(C)(C)C
Title of publication	Solvent-free mesityllithium: solid-state structure and its reactivity towards white phosphorus.
Authors of publication	Hübner, Alexander; Bernert, Thomas; Sänger, Inge; Alig, Edith; Bolte, Michael; Fink, Lothar; Wagner, Matthias; Lerner, Hans-Wolfram
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	32
Pages of publication	7528 - 7533
a	7.3483 ± 0.0016 Å
b	8.4221 ± 0.0017 Å
c	10.901 ± 0.003 Å
α	76.145 ± 0.019°
β	75.504 ± 0.019°
γ	86.082 ± 0.017°
Cell volume	634.1 ± 0.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 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	0.1355
Residual factor for significantly intense reflections	0.1166
Weighted residual factors for significantly intense reflections	0.287
Weighted residual factors for all reflections included in the refinement	0.3017
Goodness-of-fit parameter for all reflections included in the refinement	1.012
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
179966 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/60.	7026054.cif
93393	2014-01-13	cif/ Adding structures of 7026054, 7026055, 7026056 via cif-deposit CGI script.	7026054.cif