Information card for entry 7212403

Structure parameters

• Formula: C29 H26 Br N3 O8 Zn2
• Calculated formula: C29 H26 Br N3 O8 Zn2
• Title of publication: Not just size and shape: spherically symmetrical d5 and d10 metal ions give different coordination nets with 4,2′:6′,4″-terpyridines
• Authors of publication: Constable, Edwin C.; Zhang, Guoqi; Coronado, Eugenio; Housecroft, Catherine E.; Neuburger, Markus
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 7
• Pages of publication: 2139
• a: 26.0368 ± 0.0008 Å
• b: 15.0774 ± 0.0005 Å
• c: 8.0056 ± 0.0003 Å
• α: 90°
• β: 107.238 ± 0.002°
• γ: 90°
• Cell volume: 3001.57 ± 0.18 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0476
• Residual factor for significantly intense reflections: 0.026
• Weighted residual factors for all reflections: 0.0441
• Weighted residual factors for significantly intense reflections: 0.0285
• Weighted residual factors for all reflections included in the refinement: 0.0285
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0291
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No