Crystallography Open Database

Information card for entry 4331465

Preview

Coordinates	4331465.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H30 Al N O
Calculated formula	C19 H30 Al N O
SMILES	[Al]1(OC(=CC(=[N]1c1c(C(C)C)cccc1C(C)C)C)C)(C)C
Title of publication	Four- and Five-Coordinate Aluminum Ketiminate Complexes: Synthesis, Characterization, and Ring-Opening Polymerization
Authors of publication	Yu, Ru-Ching; Hung, Chen-Hsiung; Huang, Jui-Hsien; Lee, Horng-Yi; Chen, Jwu-Ting
Journal of publication	Inorganic Chemistry
Year of publication	2002
Journal volume	41
Journal issue	24
Pages of publication	6450 - 6455
a	8.9531 ± 0.0012 Å
b	13.5605 ± 0.0017 Å
c	33.193 ± 0.004 Å
α	89.897 ± 0.003°
β	89.967 ± 0.003°
γ	89.915 ± 0.002°
Cell volume	4029.9 ± 0.9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.2101
Residual factor for significantly intense reflections	0.0365
Weighted residual factors for significantly intense reflections	0.0622
Weighted residual factors for all reflections included in the refinement	0.08
Goodness-of-fit parameter for all reflections included in the refinement	0.544
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Duplicate of	4318942
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
210304 (current)	2018-09-01	cif/4/ Updating bibliography in entries 4318942-4318947, 4331465. Marking entry 4331465 as a duplicate of entry 4318942.	4331465.cif
179417	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/14.	4331465.cif
170212	2015-11-09	cif/4: Fixing some Z values and formulae.	4331465.cif
97631	2014-01-29	cif/ Adding structures of 4331465 via cif-deposit CGI script.	4331465.cif