Crystallography Open Database

Information card for entry 7043119

Preview

Coordinates	7043119.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H36 Al2 N2 O2
Calculated formula	C24 H36 Al2 N2 O2
SMILES	c1(ccc2CCC[C@H]3c2[n]1[Al]1([O]3[Al]2([n]3c(ccc4CCC[C@H](c34)[O]12)C)(C)C)(C)C)C
Title of publication	Thermo-enhanced ring-opening polymerization of ε-caprolactone: The synthesis, characterization and catalytic behavior of aluminum hydroquinolin-8-olates
Authors of publication	Zhang, Qiurui; Zhang, Wenjuan; Rajendran, Natesan Mannangatti; Liang, Tongling; Sun, Wen Hua
Journal of publication	Dalton Trans.
Year of publication	2017
a	14.644 ± 0.003 Å
b	10.016 ± 0.002 Å
c	17.708 ± 0.004 Å
α	90°
β	110.75 ± 0.03°
γ	90°
Cell volume	2428.8 ± 1 Å³
Cell temperature	173.15 K
Ambient diffraction temperature	173 ± 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	0.0977
Residual factor for significantly intense reflections	0.0899
Weighted residual factors for significantly intense reflections	0.233
Weighted residual factors for all reflections included in the refinement	0.2487
Goodness-of-fit parameter for all reflections included in the refinement	1.025
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
196988 (current)	2017-05-26	cif/ Adding structures of 7043118, 7043119, 7043120, 7043121 via cif-deposit CGI script.	7043119.cif