Crystallography Open Database

Information card for entry 7045689

Preview

Coordinates	7045689.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H45 Al N2 O
Calculated formula	C36 H45 Al N2 O
Title of publication	Living ring-opening polymerization of ε-caprolactone catalyzed by β-quinolyl-enamino aluminium complexes: ligand electronic effects.
Authors of publication	Wang, Peng; Chao, Jianbin; Chen, Xia
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	12
Pages of publication	4118 - 4127
a	9.6198 ± 0.0004 Å
b	9.7898 ± 0.0004 Å
c	19.677 ± 0.0009 Å
α	91.563 ± 0.002°
β	103.797 ± 0.001°
γ	116.983 ± 0.001°
Cell volume	1583.95 ± 0.12 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0747
Residual factor for significantly intense reflections	0.0555
Weighted residual factors for significantly intense reflections	0.1347
Weighted residual factors for all reflections included in the refinement	0.1476
Goodness-of-fit parameter for all reflections included in the refinement	1.004
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
230042 (current)	2019-11-17	cif/ Updating files of 7045687, 7045688, 7045689, 7045690, 7045691 Original log message: Adding full bibliography for 7045687--7045691.cif.	7045689.cif
206607	2018-02-23	cif/ Adding structures of 7045687, 7045688, 7045689, 7045690, 7045691 via cif-deposit CGI script.	7045689.cif