Crystallography Open Database

Information card for entry 7021013

Preview

Coordinates	7021013.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H40 Al2 N2 O2
Calculated formula	C25 H40 Al2 N2 O2
SMILES	[Al]1([N](Cc2c(O1)c(cc(c2)C)Cc1c2O[Al]([N](Cc2cc(c1)C)(C)C)(C)C)(C)C)(C)C
Title of publication	Dinuclear aluminum complexes supported by amino- or imino-phenolate ligands: synthesis, structures, and ring-opening polymerization catalysis of rac-lactide.
Authors of publication	Yu, Xiao-Feng; Wang, Zhong-Xia
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	11
Pages of publication	3860 - 3868
a	16.1331 ± 0.0015 Å
b	9.571 ± 0.0008 Å
c	22.699 ± 0.002 Å
α	90°
β	128.29 ± 0.002°
γ	90°
Cell volume	2751 ± 0.4 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1572
Residual factor for significantly intense reflections	0.0673
Weighted residual factors for significantly intense reflections	0.1509
Weighted residual factors for all reflections included in the refinement	0.1751
Goodness-of-fit parameter for all reflections included in the refinement	1.029
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
179915 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/10.	7021013.cif
75554	2013-03-10	cif/ Adding structures of 7021013, 7021014 via cif-deposit CGI script.	7021013.cif