Crystallography Open Database

Information card for entry 4078834

Preview

Coordinates	4078834.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H82 Al2 La2 N2
Calculated formula	C44 H82 Al2 La2 N2
Title of publication	Organoaluminum-Assisted Formation of Rare-Earth Metal Imide Complexes
Authors of publication	Schädle, Dorothea; Schädle, Christoph; Törnroos, Karl W.; Anwander, Reiner
Journal of publication	Organometallics
Year of publication	2012
Journal volume	31
Journal issue	14
Pages of publication	5101
a	10.5291 ± 0.0009 Å
b	14.5921 ± 0.0013 Å
c	17.0337 ± 0.0015 Å
α	76.686 ± 0.001°
β	80.847 ± 0.002°
γ	74.743 ± 0.001°
Cell volume	2443.4 ± 0.4 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 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	0.0989
Residual factor for significantly intense reflections	0.0495
Weighted residual factors for significantly intense reflections	0.0999
Weighted residual factors for all reflections included in the refinement	0.1165
Goodness-of-fit parameter for all reflections included in the refinement	0.985
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178677 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/88.	4078834.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4078834.cif
66408	2012-09-09	cif/ Adding structures of 4078833, 4078834, 4078835, 4078836 via cif-deposit CGI script.	4078834.cif