Crystallography Open Database

Information card for entry 4075155

Preview

Coordinates	4075155.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H53 I La N O2 Si5
Calculated formula	C20 H53 I La N O2 Si5
Title of publication	Heteroleptic Complexes of Lanthanum(III) and Neodymium(III) with Oxygen- or Nitrogen-Functionalized Tris(triorganosilyl)methyl Ligands
Authors of publication	Bowman, Lyndsey J.; Izod, Keith; Clegg, William; Harrington, Ross W.
Journal of publication	Organometallics
Year of publication	2006
Journal volume	25
Journal issue	12
Pages of publication	2999
a	27.3564 ± 0.0006 Å
b	27.3564 ± 0.0006 Å
c	9.1519 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	6849 ± 0.4 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	7
Space group number	86
Hermann-Mauguin space group symbol	P 42/n :2
Hall space group symbol	-P 4bc
Residual factor for all reflections	0.056
Residual factor for significantly intense reflections	0.0343
Weighted residual factors for significantly intense reflections	0.0741
Weighted residual factors for all reflections included in the refinement	0.0812
Goodness-of-fit parameter for all reflections included in the refinement	1.045
Diffraction radiation wavelength	0.6768 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178640 (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 4/07/51.	4075155.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4075155.cif
49086	2012-03-27	../uploads/cif-deposit/cod/cif Adding structures of 4075152, 4075153, 4075154, 4075155, 4075156, 4075157, 4075158 via cif-deposit CGI script.	4075155.cif