Information card for entry 4002057

Structure parameters

• Formula: C50 H44 Co2 Cu N14 O22
• Calculated formula: C50 H38 Co2 Cu N14 O22
• Title of publication: Proton Conduction in a Nonporous One Dimensional Coordination Polymer
• Authors of publication: Stankiewicz, Jolanta; Tomás, Milagros; Dobrinovitch, Isabel T.; Forcén-Vázquez, Elena; Falvello, Larry R.
• Journal of publication: Chemistry of Materials
• Year of publication: 2014
• Journal volume: 26
• Journal issue: 18
• Pages of publication: 5282
• a: 8.5422 ± 0.0003 Å
• b: 9.9173 ± 0.0004 Å
• c: 16.6816 ± 0.0007 Å
• α: 88.534 ± 0.003°
• β: 77.551 ± 0.003°
• γ: 84.358 ± 0.003°
• Cell volume: 1373.27 ± 0.09 ų
• Cell temperature: 295 ± 1 K
• Ambient diffraction temperature: 295 ± 1 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0475
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for significantly intense reflections: 0.0891
• Weighted residual factors for all reflections included in the refinement: 0.0949
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No