Information card for entry 7221023

Structure parameters

• Formula: C110 H112 Cd2 Cl3 N16 O17
• Calculated formula: C108 H108 Cd2 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: 25.2624 ± 0.0012 Å
• b: 25.0809 ± 0.0011 Å
• c: 16.7959 ± 0.0008 Å
• α: 90°
• β: 92.522 ± 0.003°
• γ: 90°
• Cell volume: 10631.6 ± 0.9 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: 0.1279
• Residual factor for significantly intense reflections: 0.1026
• Weighted residual factors for all reflections: 0.3071
• Weighted residual factors for significantly intense reflections: 0.2838
• Weighted residual factors for all reflections included in the refinement: 0.3071
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9905
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No