Information card for entry 7247896

Structure parameters

• Formula: C27 H30 Cl2 Co N8 O11
• Calculated formula: C26 H26 Cl2 Co N8 O10
• Title of publication: Adaptable 2,5-bis((1,2,3-triazol-4-yl)methoxy)pyrazine ligands for the simple self-assembly of homoleptic 1D coordination polymers
• Authors of publication: Donaldson, Marryllyn E.; Dais, Tyson N.; Rowlands, Gareth J.; Matheson, Brodie E.; Plieger, Paul G.
• Journal of publication: CrystEngComm
• Year of publication: 2024
• Journal volume: 26
• Journal issue: 4
• Pages of publication: 504 - 516
• a: 9.8467 ± 0.0006 Å
• b: 12.6342 ± 0.0008 Å
• c: 12.9571 ± 0.0008 Å
• α: 85.731 ± 0.003°
• β: 85.591 ± 0.004°
• γ: 88.909 ± 0.003°
• Cell volume: 1602.56 ± 0.17 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.082
• Residual factor for significantly intense reflections: 0.0763
• Weighted residual factors for significantly intense reflections: 0.211
• Weighted residual factors for all reflections included in the refinement: 0.2201
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No