Information card for entry 7003125

Structure parameters

• Formula: C52 H67 Cu4 N11 O22 P2
• Calculated formula: C52 H54.5 Cu4 N10.915 O20.58 P2
• Title of publication: Synthesis, structure, magnetism and nuclease activity of tetranuclear copper(ii) phosphonates containing ancillary 2,2′-bipyridine or 1,10-phenanthroline ligands
• Authors of publication: Chandrasekhar, Vadapalli; Azhakar, Ramachandran; Senapati, Tapas; Thilagar, Pakkirisamy; Ghosh, Surajit; Verma, Sandeep; Boomishankar, Ramamoorthy; Steiner, Alexander; Kögerler, Paul
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 9
• Pages of publication: 1150 - 1160
• a: 13.3151 ± 0.001 Å
• b: 15.069 ± 0.0011 Å
• c: 32.232 ± 0.002 Å
• α: 81.051 ± 0.001°
• β: 87.441 ± 0.001°
• γ: 78.351 ± 0.001°
• Cell volume: 6256.3 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0763
• Residual factor for significantly intense reflections: 0.0646
• Weighted residual factors for significantly intense reflections: 0.1749
• Weighted residual factors for all reflections included in the refinement: 0.1834
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No