Information card for entry 7044229

Structure parameters

• Formula: C94 H122 Cl4 Cu3 N8 O24 P4
• Calculated formula: C94 H122 Cl4 Cu3 N8 O24 P4
• Title of publication: Selective formation of discrete versus polymeric copper organophosphates: DNA cleavage and cytotoxic activity
• Authors of publication: Bhat, Gulzar A.; Maqbool, Raihana; Dar, Aijaz; Hussain, Mahboob Ul; Murugavel, Ramaswamy
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 10.26 ± 0.002 Å
• b: 14.003 ± 0.003 Å
• c: 19.176 ± 0.004 Å
• α: 94.8 ± 0.03°
• β: 99.73 ± 0.03°
• γ: 111.01 ± 0.03°
• Cell volume: 2503.5 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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 all reflections: 0.0644
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.1194
• Weighted residual factors for all reflections included in the refinement: 0.1312
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No