Crystallography Open Database

Information card for entry 4303963

Preview

Coordinates	4303963.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H44 Cl4 Ga2 Si2
Calculated formula	C28 H44 Cl4 Ga2 Si2
SMILES	c1(ccccc1)/C=C(\[Ga]1(Cl)[Cl][Ga](C(=C\c2ccccc2)/[Si](C)(C)C)([Cl]1)Cl)[Si](C)(C)C.C(CCC)CC
Title of publication	Hydrogallation of Alkynes with H-GaCl2: Formation of Organoelement Dichlorogallium Compounds Potentially Applicable as Chelating Lewis Acids
Authors of publication	Werner Uhl; Michael Claesener
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	4463 - 4470
a	9.6122 ± 0.001 Å
b	15.8246 ± 0.0016 Å
c	22.638 ± 0.002 Å
α	90°
β	92.645 ± 0.002°
γ	90°
Cell volume	3439.8 ± 0.6 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0488
Residual factor for significantly intense reflections	0.036
Weighted residual factors for significantly intense reflections	0.0831
Weighted residual factors for all reflections included in the refinement	0.088
Goodness-of-fit parameter for all reflections included in the refinement	1.014
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
179077 (current)	2016-03-22	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/39.	4303963.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4303963.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4303963.cif
1163	2010-05-11	cif/4/: committing data from the Inorg-Chem-2008_01-12/ deposition.	4303963.cif