Information card for entry 7017174

Structure parameters

• Common name: diaquo((±)-2,7,12-trimethoxy-3,8,13-tris(4-(4- pyridyl)benzoyl)-10,15-dihydro-5H-tribenzo(a,d,g)cyclononane)cobalt(ii) nitrate
• Chemical name: diaquo[(±)-2,7,12-trimethoxy-3,8,13- tris[4-(4-pyridyl)benzoyl]-10,15-dihydro-5H- tribenzo[a,d,g]cyclononane]cobalt(II) nitrate
• Formula: C66 H61 Co N5 O13
• Calculated formula: C60 H45 Co N3 O11
• Title of publication: New coordination polymers with extended arm cyclotriguaiacyclene ligands: 1D chains, and interpenetrating or polycatenating 2D (4(2).6(2))(4.6(2))(2) networks.
• Authors of publication: Little, Marc A.; Ronson, Tanya K.; Hardie, Michaele J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 45
• Pages of publication: 12217 - 12227
• a: 16.2313 ± 0.0008 Å
• b: 16.7654 ± 0.0009 Å
• c: 17.7506 ± 0.0009 Å
• α: 112.858 ± 0.002°
• β: 94.933 ± 0.002°
• γ: 101.901 ± 0.002°
• Cell volume: 4280.8 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1147
• Residual factor for significantly intense reflections: 0.0895
• Weighted residual factors for significantly intense reflections: 0.2278
• Weighted residual factors for all reflections included in the refinement: 0.2364
• Goodness-of-fit parameter for all reflections included in the refinement: 1.503
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No