Information card for entry 7018701

Structure parameters

• Formula: C28 H16 Bi Li5 N4 O18
• Calculated formula: C28 H13 Bi Li5 N4 O18
• Title of publication: Bismuth 2,6-pyridinedicarboxylates: Assembly of molecular units into coordination polymers, CO(2) sorption and photoluminescence.
• Authors of publication: Thirumurugan, A.; Li, Wei; Cheetham, Anthony K.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 14
• Pages of publication: 4126 - 4134
• a: 9.674 ± 0.005 Å
• b: 11.078 ± 0.005 Å
• c: 16.972 ± 0.005 Å
• α: 90°
• β: 115.427 ± 0.018°
• γ: 90°
• Cell volume: 1642.7 ± 1.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0294
• Residual factor for significantly intense reflections: 0.0285
• Weighted residual factors for significantly intense reflections: 0.0777
• Weighted residual factors for all reflections included in the refinement: 0.0783
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No