Crystallography Open Database

Information card for entry 4080174

Preview

Coordinates	4080174.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H50 Al N2
Calculated formula	C32 H50 Al N2
Title of publication	Synthesis and Reactions of a Redox-Active α-Diimine Aluminum Complex
Authors of publication	Li, Jianfeng; Zhang, Kun; Huang, Hanmin; Yu, Ao; Hu, Hongfan; Cui, Haiyan; Cui, Chunming
Journal of publication	Organometallics
Year of publication	2013
Journal volume	32
Journal issue	6
Pages of publication	1630
a	10.106 ± 0.003 Å
b	14.562 ± 0.003 Å
c	20.551 ± 0.005 Å
α	90°
β	93.202 ± 0.008°
γ	90°
Cell volume	3019.6 ± 1.3 Å³
Cell temperature	113 ± 2 K
Ambient diffraction temperature	113 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0794
Residual factor for significantly intense reflections	0.0697
Weighted residual factors for significantly intense reflections	0.1764
Weighted residual factors for all reflections included in the refinement	0.189
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178690 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/01.	4080174.cif
85866	2013-05-07	cif/ Adding structures of 4080174, 4080175, 4080176 via cif-deposit CGI script.	4080174.cif