Crystallography Open Database

Information card for entry 7056741

Preview

Coordinates	7056741.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H48 Ga2 N2 O4
Calculated formula	C28 H48 Ga2 N2 O4
SMILES	[C@@H](COc1ccccc1)(CNC(C)C)[O]1[Ga](C)(C)[O]([C@H](COc2ccccc2)CNC(C)C)[Ga]1(C)C.[C@H](COc1ccccc1)(CNC(C)C)[O]1[Ga](C)(C)[O]([C@@H](COc2ccccc2)CNC(C)C)[Ga]1(C)C
Title of publication	Dialkylgallium alkoxides – a tool for facile and stereoselective synthesis of PLA-drug conjugates
Authors of publication	Cybularczyk, Martyna; Zaremba, Rafał; Hurko, Aleksander; Plichta, Andrzej Tadeusz; Dranka, Maciej; Horeglad, Paweł
Journal of publication	New Journal of Chemistry
Year of publication	2017
Journal volume	41
Journal issue	24
Pages of publication	14851 - 14854
a	21.4049 ± 0.0007 Å
b	8.2553 ± 0.0003 Å
c	18.0932 ± 0.0005 Å
α	90°
β	100.559 ± 0.003°
γ	90°
Cell volume	3143 ± 0.18 Å³
Cell temperature	293 ± 1 K
Ambient diffraction temperature	293 ± 1 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	0.0269
Residual factor for significantly intense reflections	0.0221
Weighted residual factors for significantly intense reflections	0.0584
Weighted residual factors for all reflections included in the refinement	0.062
Goodness-of-fit parameter for all reflections included in the refinement	1.063
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
301442 (current)	2025-08-04	Updating journal pages, volumes and years from the data sent by Robert McMeeking. cod/ (saulius@pterodaktilis)	7056741.cif
203031	2017-11-10	cif/ Adding structures of 7056740, 7056741, 7056742 via cif-deposit CGI script.	7056741.cif