Crystallography Open Database

Information card for entry 4070120

Preview

Coordinates	4070120.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H43 Cu Ge N4
Calculated formula	C22 H43 Cu Ge N4
SMILES	[GeH]1([Cu]2N(C(=CC(=[N]2C(C)C)C)C)C(C)C)[N](=C(C)C=C(N1C(C)C)C)C(C)C
Title of publication	Spectroscopic and Structural Characterization of Copper−Germylene Complexes Bearing an Isopropyl-Substituted β-Diketiminate Ligand
Authors of publication	Arii, Hidekazu; Nakadate, Fumiya; Mochida, Kunio
Journal of publication	Organometallics
Year of publication	2009
Journal volume	28
Journal issue	17
Pages of publication	4909
a	9.992 ± 0.0008 Å
b	13.507 ± 0.0006 Å
c	18.885 ± 0.0016 Å
α	90°
β	94.944 ± 0.004°
γ	90°
Cell volume	2539.3 ± 0.3 Å³
Cell temperature	120 K
Ambient diffraction temperature	120 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0905
Residual factor for significantly intense reflections	0.072
Weighted residual factors for significantly intense reflections	0.1912
Weighted residual factors for all reflections included in the refinement	0.2111
Goodness-of-fit parameter for all reflections included in the refinement	1.032
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
178590 (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 4/07/01.	4070120.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4070120.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4070120.cif
40603	2012-03-08	../uploads/cif-deposit/cod/cif Adding structures of 4070119, 4070120, 4070121, 4070122 via cif-deposit CGI script.	4070120.cif