Information card for entry 7028032

Structure parameters

• Formula: C14 H40 Cl4 Cu2 N8 O18
• Calculated formula: C14 H40 Cl4 Cu2 N8 O18
• Title of publication: A novel tricopper(II) complex of a polyamine alcohol †
• Authors of publication: Bernhardt, Paul V.; Sharpe, Philip C.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1998
• Journal issue: 7
• Pages of publication: 1087
• a: 15.215 ± 0.004 Å
• b: 14.914 ± 0.001 Å
• c: 15.528 ± 0.003 Å
• α: 90°
• β: 103.08 ± 0.01°
• γ: 90°
• Cell volume: 3432.1 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0764
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for all reflections: 0.141
• Weighted residual factors for significantly intense reflections: 0.121
• Goodness-of-fit parameter for all reflections: 1.022
• Goodness-of-fit parameter for significantly intense reflections: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No