Crystallography Open Database

Information card for entry 4065751

Preview

Coordinates	4065751.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H26 Ga2 O6
Calculated formula	C12 H26 Ga2 O6
SMILES	[Ga]1([O]([Ga]([O]1[C@@H](C)C(=O)OC)(C)C)[C@@H](C)C(=O)OC)(C)C
Title of publication	Heteroselective Polymerization ofrac-Lactide in the Presence of Dialkylgallium Alkoxides: The Effect of Lewis Base on Polymerization Stereoselectivity
Authors of publication	Horeglad, Paweł; Kruk, Przemysław; Pécaut, Jacques
Journal of publication	Organometallics
Year of publication	2010
Journal volume	29
Journal issue	17
Pages of publication	3729
a	7.16603 ± 0.00018 Å
b	16.0451 ± 0.0004 Å
c	7.92429 ± 0.00017 Å
α	90°
β	91.443 ± 0.002°
γ	90°
Cell volume	910.84 ± 0.04 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0334
Residual factor for significantly intense reflections	0.0286
Weighted residual factors for significantly intense reflections	0.0624
Weighted residual factors for all reflections included in the refinement	0.0631
Goodness-of-fit parameter for all reflections included in the refinement	0.964
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4065751.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4065751.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4065751.cif
33677	2012-02-13	../uploads/cif-deposit/cod/cif Adding structures of 4065751 via cif-deposit CGI script.	4065751.cif