Crystallography Open Database

Information card for entry 4087406

Preview

Coordinates	4087406.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H39 Ga N2 O2
Calculated formula	C26 H39 Ga N2 O2
SMILES	[Ga](OCCOC)(=C1N(CCN1c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C)(C)C
Title of publication	Dialkylgallium Alkoxides Stabilized with N-Heterocyclic Carbenes: Opportunities and Limitations for the Controlled and Stereoselective Polymerization of rac-Lactide
Authors of publication	Horeglad, Paweł; Cybularczyk, Martyna; Trzaskowski, Bartosz; Żukowska, Grażyna Zofia; Dranka, Maciej; Zachara, Janusz
Journal of publication	Organometallics
Year of publication	2015
Journal volume	34
Journal issue	14
Pages of publication	3480
a	14.30884 ± 0.00015 Å
b	12.19363 ± 0.00014 Å
c	14.5121 ± 0.00017 Å
α	90°
β	90°
γ	90°
Cell volume	2532.02 ± 0.05 Å³
Cell temperature	100 ± 0.2 K
Ambient diffraction temperature	100 ± 0.2 K
Number of distinct elements	5
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for all reflections	0.0239
Residual factor for significantly intense reflections	0.0218
Weighted residual factors for significantly intense reflections	0.0528
Weighted residual factors for all reflections included in the refinement	0.054
Goodness-of-fit parameter for all reflections included in the refinement	1.047
Diffraction radiation probe	x-ray
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
236781 (current)	2019-11-24	cif/ Adding structures of 4087406 via cif-deposit CGI script.	4087406.cif