Crystallography Open Database

Information card for entry 7004965

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Coordinates	7004965.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C88 H128 N6 Yb
Calculated formula	C88 H120 N6 Yb
Title of publication	Homoleptic lanthanide(II)-bis(guanidinate) complexes, [Ln(Giso)(2)] (Giso = [(ArN)(2)CN(C(6)H(11))(2)](-), Ar = C(6)H(3)Pr(i)(2)-2,6): planar 4-coordinate (Ln = Sm or Eu) vs distorted tetrahedral (Ln = Yb) geometries.
Authors of publication	Heitmann, Dennis; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Stasch, Andreas
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2007
Journal issue	2
Pages of publication	187 - 189
a	13.822 ± 0.003 Å
b	16.195 ± 0.003 Å
c	17.916 ± 0.004 Å
α	89.75 ± 0.03°
β	78.04 ± 0.03°
γ	84.48 ± 0.03°
Cell volume	3904.7 ± 1.5 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0544
Residual factor for significantly intense reflections	0.0426
Weighted residual factors for significantly intense reflections	0.093
Weighted residual factors for all reflections included in the refinement	0.0983
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	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179753 (current)	2016-03-25	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/49.	7004965.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7004965.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7004965.cif
1186	2010-06-03	Adding CIFs from Chem-Comm-2010_20-22/ and Dalton-Trans-2007/ processing.	7004965.cif