Information card for entry 7037471

Structure parameters

• Formula: C60 H78 Cd2 N22 O39 P6
• Calculated formula: C60 H78 Cd2 N22 O39 P6
• Title of publication: Molecular, 1D and 2D assemblies from hexakis(3-pyridyloxy)cyclophosphazene containing 20-membered metallamacrocyclic motifs.
• Authors of publication: Suriya Narayanan, Ramakirushnan; Chandrasekhar, Vadapalli
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 5
• Pages of publication: 2273 - 2283
• a: 11.634 ± 0.005 Å
• b: 12.742 ± 0.005 Å
• c: 16.197 ± 0.005 Å
• α: 97.615 ± 0.005°
• β: 93.25 ± 0.005°
• γ: 106.564 ± 0.005°
• Cell volume: 2269.8 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1146
• Residual factor for significantly intense reflections: 0.091
• Weighted residual factors for significantly intense reflections: 0.2616
• Weighted residual factors for all reflections included in the refinement: 0.292
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No