Information card for entry 4325674

Structure parameters

• Formula: C30 H24 N12 O6 Zn2
• Calculated formula: C30 H24 N12 O6 Zn2
• Title of publication: Coordination Polymers of Hexacyanotrimethylenecyclopropanediide and Its Monoanionic Radical: Synthesis, Structure, and Magnetic Properties
• Authors of publication: Anna M. Kutasi; David R. Turner; Paul Jensen; Boujemaa Moubaraki; Stuart R. Batten; Keith S. Murray
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 6673 - 6684
• a: 7.7992 ± 0.0004 Å
• b: 8.8762 ± 0.0005 Å
• c: 12.4565 ± 0.0006 Å
• α: 87.501 ± 0.002°
• β: 81.428 ± 0.002°
• γ: 85.617 ± 0.002°
• Cell volume: 849.75 ± 0.08 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0383
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.0703
• Weighted residual factors for all reflections included in the refinement: 0.0729
• Goodness-of-fit parameter for all reflections included in the refinement: 1.118
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No