Information card for entry 2218228

Structure parameters

• Chemical name: Poly[[μ~4~-naphthalene-1,4-dicarboxylato- κ^4^<i>O</i>:<i>O</i>':<i>O</i>'':<i>O</i>'''- μ~2~-naphthalene-1,4-dicarboxylato- κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>'''- bis(2-phenyl-1<i>H</i>-1,3,7,8-tetraazacyclopenta[<i>l</i>]phenanthrene- κ^2^<i>N</i>^7^,<i>N</i>^8^)dimanganese(II)] <i>N</i>,<i>N</i>-dimethylformamide solvate]
• Formula: C65 H43 Mn2 N9 O9
• Calculated formula: C65 H43 Mn2 N9 O9
• Title of publication: Poly[[μ~4~-naphthalene-1,4-dicarboxylato-κ^4^<i>O</i>:<i>O</i>':<i>O</i>'':<i>O</i>'''-μ~2~-naphthalene-1,4-dicarboxylato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>'''-bis(2-phenyl-1<i>H</i>-1,3,7,8-tetraazacyclopenta[<i>l</i>]phenanthrene-κ^2^<i>N</i>^7^,<i>N</i>^8^)dimanganese(II)] <i>N</i>,<i>N</i>-dimethylformamide solvate]
• Authors of publication: Li, Heng-Da; Liu, Yang; Xu, Mao-Liang; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 5
• Pages of publication: m704 - m705
• a: 9.24 ± 0.002 Å
• b: 14.852 ± 0.005 Å
• c: 21.921 ± 0.005 Å
• α: 105.72 ± 0.01°
• β: 100.48 ± 0.01°
• γ: 101.67 ± 0.01°
• Cell volume: 2745.1 ± 1.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.1574
• Residual factor for significantly intense reflections: 0.0801
• Weighted residual factors for significantly intense reflections: 0.2174
• Weighted residual factors for all reflections included in the refinement: 0.2616
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes