Information card for entry 7013831

Structure parameters

• Formula: C31 H31 Br3 Cl Cu2 N7 O4
• Calculated formula: C31 H31 Br3 Cl Cu2 N7 O4
• Title of publication: Novel one-dimensional structures and solution behaviour of copper(II) bromide and chloride complexes of a new pentapyridyldiamine ligand.
• Authors of publication: Lonnon, David G.; Craig, Donald C.; Colbran, Stephen B.; Bernhardt, Paul V.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 5
• Pages of publication: 778 - 787
• a: 8.896 ± 0.004 Å
• b: 10.771 ± 0.006 Å
• c: 19.092 ± 0.009 Å
• α: 96.06 ± 0.03°
• β: 96.45 ± 0.03°
• γ: 103.43 ± 0.03°
• Cell volume: 1751.6 ± 1.5 ų
• Cell temperature: 294 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for all reflections included in the refinement: 0.068
• Goodness-of-fit parameter for all reflections included in the refinement: 1.83
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No