Information card for entry 7004110

Structure parameters

• Formula: C18 H18 Co N4 O6
• Calculated formula: C18 H18 Co N4 O6
• Title of publication: Hydrogen-bond-directing effect in the ionothermal synthesis of metal coordination polymers
• Authors of publication: Lin, Zhuojia; Li, Yang; Slawin, Alexandra M. Z.; Morris, Russell E.
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 30
• Pages of publication: 3989 - 3994
• a: 7.677 ± 0.0014 Å
• b: 16.387 ± 0.002 Å
• c: 8.2916 ± 0.0015 Å
• α: 90°
• β: 116.458 ± 0.003°
• γ: 90°
• Cell volume: 933.9 ± 0.3 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0595
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.086
• Weighted residual factors for all reflections included in the refinement: 0.0967
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No