Information card for entry 7021652

Structure parameters

• Common name: Co-CFA1
• Formula: C44 H30 Co1.34 N18 O8 Zn3.66
• Calculated formula: C44 H29.97 Co1.35 N18 O7.98 Zn3.65
• Title of publication: CFA-1: the first chiral metal-organic framework containing Kuratowski-type secondary building units.
• Authors of publication: Schmieder, Phillip; Denysenko, Dmytro; Grzywa, Maciej; Baumgärtner, Benjamin; Senkovska, Irena; Kaskel, Stefan; Sastre, German; van Wüllen, Leo; Volkmer, Dirk
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 30
• Pages of publication: 10786 - 10797
• a: 17.7771 ± 0.0007 Å
• b: 17.7771 ± 0.0007 Å
• c: 19.1129 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 5230.9 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 150
• Hermann-Mauguin space group symbol: P 3 2 1
• Hall space group symbol: P 3 2"
• Residual factor for all reflections: 0.0653
• Residual factor for significantly intense reflections: 0.0626
• Weighted residual factors for all reflections: 0.0642
• Weighted residual factors for significantly intense reflections: 0.0637
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 1.54051 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No