Crystallography Open Database

Information card for entry 7701082

Preview

Coordinates	7701082.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H52 Cu2 F6 K N4 O8 P
Calculated formula	C42 H52 Cu2 F6 K N4 O8 P
Title of publication	Elucidating the secondary effect in the Lewis acid mediated anodic shift of electrochemical oxidation of a Cu(ii) complex with a N<sub>2</sub>O<sub>2</sub> donor unsymmetrical ligand.
Authors of publication	Maity, Souvik; Ghosh, Soumavo; Ghosh, Ashutosh
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	39
Pages of publication	14898 - 14913
a	16.0432 ± 0.0008 Å
b	15.9972 ± 0.0008 Å
c	18.3751 ± 0.001 Å
α	90°
β	92.343 ± 0.003°
γ	90°
Cell volume	4712 ± 0.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	8
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	0.132
Residual factor for significantly intense reflections	0.0961
Weighted residual factors for significantly intense reflections	0.289
Weighted residual factors for all reflections included in the refinement	0.33
Goodness-of-fit parameter for all reflections included in the refinement	1.238
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
224047 (current)	2019-11-07	cif/ Updating files of 7701082, 7701083 Original log message: Adding full bibliography for 7701082--7701083.cif.	7701082.cif
218109	2019-09-10	cif/ Adding structures of 7701082, 7701083 via cif-deposit CGI script.	7701082.cif