Crystallography Open Database

Information card for entry 7702438

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Coordinates	7702438.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	bis(nitrilo-tris(methylenephenylphosphinate)copper(II)Pyridine), bis-acetone
Formula	C58 H66 Cu2 N4 O14 P6
Calculated formula	C58 H52 Cu2 N4 O14 P6
Title of publication	Complexes of the tripodal nitrilotrimethylenetrisphosphonic (H6L) and P,P′,P ″-triphenylnitrilotrimethylenetrisphosphinic (H3L°) acids with the copper(II) ion. Synthesis and characterization of [Hpy][Cu(H3L)(H2O)] and [Cu(HL°)(py)]2·2Me2CO†
Authors of publication	Cecconi, Franco; Ghilardi, Carlo A.; Lorenzo Luis, Pablo A.; Midollini, Stefano; Orlandini, Annabella; Dakternieks, Dainis; Duthie, Andrew; Dominguez, Sixto; Berti, Elisabetta; Vacca, Alberto
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2001
Journal issue	2
Pages of publication	211
a	11.162 ± 0.005 Å
b	12.414 ± 0.009 Å
c	13.967 ± 0.006 Å
α	63.75 ± 0.04°
β	85.75 ± 0.04°
γ	65.04 ± 0.04°
Cell volume	1558.5 ± 1.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.2027
Residual factor for significantly intense reflections	0.0686
Weighted residual factors for all reflections	0.1899
Weighted residual factors for significantly intense reflections	0.1435
Goodness-of-fit parameter for all reflections	0.963
Goodness-of-fit parameter for significantly intense reflections	1.068
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
243867 (current)	2019-11-28	cif/ Adding structures of 7702438, 7702439 via cif-deposit CGI script.	7702438.cif