Crystallography Open Database

Information card for entry 4349521

Preview

Coordinates	4349521.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Catena{(diethyl-(2,2-dimethyl-1-(tert-butyl-(1-(pyridine-4-yl)ethoxy)amino) propyl)phosphonate-N,O)bis(1,1,1,5,5,5-hexafluoropentane-2,4- dionato)copper}
Formula	C30 H39 Cu F12 N4 O8 P
Calculated formula	C30 H39 Cu F12 N2 O8 P
Title of publication	C‒ON bond homolysis of alkoxyamines triggered by paramagnetic copper(ii) salts
Authors of publication	Audran, Gérard; Bagryanskaya, Elena; Bagryanskaya, Irina; Brémond, Paul; Edeleva, Mariya; Marque, Sylvain R. A.; Parkhomenko, Dmitriy; Tretyakov, Evgeny; Zhivetyeva, Svetlana
Journal of publication	Inorganic Chemistry Frontiers
Year of publication	2016
Journal volume	3
Journal issue	11
Pages of publication	1464
a	10.631 ± 0.0003 Å
b	11.8915 ± 0.0004 Å
c	32.1197 ± 0.0011 Å
α	90°
β	98.907 ± 0.002°
γ	90°
Cell volume	4011.6 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
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	0.1192
Residual factor for significantly intense reflections	0.0649
Weighted residual factors for significantly intense reflections	0.1661
Weighted residual factors for all reflections included in the refinement	0.1993
Goodness-of-fit parameter for all reflections included in the refinement	1.082
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
234851 (current)	2019-11-23	cif/ Adding structures of 4349520, 4349521, 4349522, 4349523 via cif-deposit CGI script.	4349521.cif