Information card for entry 7702438

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 ų
• 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 Fobs: No