Information card for entry 7227476

Structure parameters

• Formula: C73 H49 B2 Cl3 F4 N10 O4
• Calculated formula: C73 H49 B2 Cl3 F4 N10 O4
• Title of publication: AzaBODIPY based coordination polymers
• Authors of publication: Mazel, Antoine; Baudron, Stéphane A.; Hosseini, Mir Wais
• Journal of publication: CrystEngComm
• Year of publication: 2017
• Journal volume: 19
• Journal issue: 6
• Pages of publication: 897
• a: 16.8878 ± 0.0011 Å
• b: 13.8408 ± 0.0013 Å
• c: 14.4153 ± 0.0013 Å
• α: 90°
• β: 109.557 ± 0.002°
• γ: 90°
• Cell volume: 3175.1 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1405
• Residual factor for significantly intense reflections: 0.0761
• Weighted residual factors for significantly intense reflections: 0.1762
• Weighted residual factors for all reflections included in the refinement: 0.2059
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No