Information card for entry 4332837

Structure parameters

• Formula: C27 H39 Cu F12 N4 O5 P2
• Calculated formula: C27 H31 Cu F12 N4 O5 P2
• Title of publication: Flexible and Shape-Selective Guest Binding at CuIIAxial Sites in 1-Dimensional CuII−1,2-Bis(4-pyridyl)ethane Coordination Polymers
• Authors of publication: Noro, Shin-ichiro; Horike, Satoshi; Tanaka, Daisuke; Kitagawa, Susumu; Akutagawa, Tomoyuki; Nakamura, Takayoshi
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 23
• Pages of publication: 9290 - 9300
• a: 9.3168 ± 0.0016 Å
• b: 23.612 ± 0.005 Å
• c: 16.71 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3676 ± 1.5 ų
• Cell temperature: 103.1 K
• Number of distinct elements: 7
• Space group number: 57
• Hermann-Mauguin space group symbol: P b c m
• Hall space group symbol: -P 2c 2b
• Residual factor for significantly intense reflections: 0.0628
• Weighted residual factors for all reflections included in the refinement: 0.1335
• Goodness-of-fit parameter for all reflections included in the refinement: 0.751
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No