Information card for entry 7004209

Structure parameters

• Formula: C56 H90 Cu4 I4 N14 O4 P4
• Calculated formula: C56 H90 Cu4 I4 N14 O4 P4
• Title of publication: Novel octanuclear copper(i) metallomacrocycles and their transformation into hexanuclear 2-dimensional grids of copper(i) coordination polymers containing cyclodiphosphazanes, [(μ-NtBuP)2(NC4H8X)2] (X = NMe, O)
• Authors of publication: Suresh, D.; Balakrishna, Maravanji S.; Mague, Joel T.
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 25
• Pages of publication: 3272 - 3274
• a: 22.928 ± 0.001 Å
• b: 14.8182 ± 0.0007 Å
• c: 21.085 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7163.7 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.0374
• Residual factor for significantly intense reflections: 0.0281
• Weighted residual factors for significantly intense reflections: 0.0578
• Weighted residual factors for all reflections included in the refinement: 0.0623
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No