Information card for entry 7221022

Structure parameters

• Formula: C107 H103 Cd2 Cl9 N16 O16
• Calculated formula: C105 H101 Cd2 Cl3 N16 O16
• Title of publication: Manipulating connecting nodes through remote alkoxy chain variation in coordination networks with 4′-alkoxy-4,2′:6′,4′′-terpyridine linkers
• Authors of publication: Klein, Y. Maximilian; Prescimone, Alessandro; Constable, Edwin C.; Housecroft, Catherine E.
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 34
• Pages of publication: 6483
• a: 25.945 ± 0.006 Å
• b: 24.578 ± 0.005 Å
• c: 17.527 ± 0.003 Å
• α: 90°
• β: 91.069 ± 0.009°
• γ: 90°
• Cell volume: 11175 ± 4 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 6
• 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: 0.1419
• Residual factor for significantly intense reflections: 0.134
• Weighted residual factors for all reflections: 0.3513
• Weighted residual factors for significantly intense reflections: 0.3465
• Weighted residual factors for all reflections included in the refinement: 0.3513
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0024
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No