Crystallography Open Database

Information card for entry 7700691

Preview

Coordinates	7700691.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H46 Cl Ir N4
Calculated formula	C30 H46 Cl Ir N4
Title of publication	Cu(i), Ag(i), Ni(ii), Cr(iii) and Ir(i) complexes with tritopic N<sup>imine</sup>C<sup>NHC</sup>N<sup>amine</sup> pincer ligands and catalytic ethylene oligomerization.
Authors of publication	Ren, Xiaoyu; Wesolek, Marcel; Braunstein, Pierre
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	34
Pages of publication	12895 - 12909
a	8.4032 ± 0.0004 Å
b	11.1493 ± 0.0005 Å
c	16.7862 ± 0.0007 Å
α	105.21 ± 0.001°
β	104.489 ± 0.001°
γ	96.004 ± 0.001°
Cell volume	1444.74 ± 0.11 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 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	0.0254
Residual factor for significantly intense reflections	0.0199
Weighted residual factors for significantly intense reflections	0.0424
Weighted residual factors for all reflections included in the refinement	0.0441
Goodness-of-fit parameter for all reflections included in the refinement	1.068
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
224519 (current)	2019-11-08	cif/ Updating files of 7700685, 7700686, 7700687, 7700688, 7700689, 7700690, 7700691, 7700692 Original log message: Adding full bibliography for 7700685--7700692.cif.	7700691.cif
217312	2019-07-31	cif/ Adding structures of 7700685, 7700686, 7700687, 7700688, 7700689, 7700690, 7700691, 7700692 via cif-deposit CGI script.	7700691.cif