Crystallography Open Database

Information card for entry 4350114

Preview

Coordinates	4350114.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[Cu(L2)Cl]ClO4
Formula	C25 H39 Cl2 Cu N9 O6
Calculated formula	C25 H21 Cl2 Cu N9 O6
Title of publication	Structural and spectroscopic characterization of copper(II) complexes of a new bisamide functionalized imidazole tripod and evidence for the formation of a mononuclear end-on Cu-OOH species.
Authors of publication	Cheruzel, Lionel E.; Cecil, Matthew R.; Edison, Sara E.; Mashuta, Mark S.; Baldwin, Michael J.; Buchanan, Robert M.
Journal of publication	Inorganic chemistry
Year of publication	2006
Journal volume	45
Journal issue	8
Pages of publication	3191 - 3202
a	18.908 ± 0.009 Å
b	20.14 ± 0.009 Å
c	11.196 ± 0.005 Å
α	90°
β	94.606 ± 0.008°
γ	90°
Cell volume	4250 ± 3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1549
Residual factor for significantly intense reflections	0.0739
Weighted residual factors for significantly intense reflections	0.1384
Weighted residual factors for all reflections included in the refinement	0.1504
Goodness-of-fit parameter for all reflections included in the refinement	1.065
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
239746 (current)	2019-11-25	cif/ Adding structures of 4350113, 4350114, 4350115, 4350116 via cif-deposit CGI script.	4350114.cif