Crystallography Open Database

Information card for entry 7024164

Preview

Coordinates	7024164.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H38 Al Cl2 Li N2 O2
Calculated formula	C27 H38 Al Cl2 Li N2 O2
SMILES	ClCCl.[AlH2]1N(c2c([O]3c4ccccc4[N]1(C1CCCC1)[Li]3[O]1CCCC1)cccc2)C1CCCC1
Title of publication	Synthesis and structural characterization of well-defined anionic aluminum alkoxide complexes supported by NON-type diamido ether tridentate ligands and their use for the controlled ROP of lactide.
Authors of publication	Hild, Frédéric; Haquette, Pierre; Brelot, Lydia; Dagorne, Samuel
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	2
Pages of publication	533 - 540
a	9.531 ± 0.0003 Å
b	12.933 ± 0.0005 Å
c	13.383 ± 0.0004 Å
α	102.921 ± 0.0018°
β	109.009 ± 0.0017°
γ	107.777 ± 0.0016°
Cell volume	1386.31 ± 0.09 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0614
Residual factor for significantly intense reflections	0.0476
Weighted residual factors for significantly intense reflections	0.1359
Weighted residual factors for all reflections included in the refinement	0.1588
Goodness-of-fit parameter for all reflections included in the refinement	1.114
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
179946 (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 7/02/41.	7024164.cif
92215	2014-01-12	cif/ Adding structures of 7024164, 7024165, 7024166, 7024167 via cif-deposit CGI script.	7024164.cif