Crystallography Open Database

Information card for entry 7700692

Preview

Coordinates	7700692.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H50 Cl3 Cr N4
Calculated formula	C36 H50 Cl3 Cr 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	11.6017 ± 0.0004 Å
b	18.8201 ± 0.0007 Å
c	32.9818 ± 0.0011 Å
α	90°
β	90°
γ	90°
Cell volume	7201.4 ± 0.4 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0861
Residual factor for significantly intense reflections	0.0502
Weighted residual factors for significantly intense reflections	0.1003
Weighted residual factors for all reflections included in the refinement	0.112
Goodness-of-fit parameter for all reflections included in the refinement	1.022
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
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.	7700692.cif
217312	2019-07-31	cif/ Adding structures of 7700685, 7700686, 7700687, 7700688, 7700689, 7700690, 7700691, 7700692 via cif-deposit CGI script.	7700692.cif