Information card for entry 7007392

Structure parameters

• Formula: C31 H60 F12 N8 Ni2 O3 P2
• Calculated formula: C31 H60 F12 N8 Ni2 O3 P2
• Title of publication: Structure and magnetic properties of carbonate-bridged five-coordinate nickel(II) complexes controlled by solvent effect.
• Authors of publication: Lozano, A. Abel; Sáez, Magalí; Pérez, José; García, Luís; Lezama, Luís; Rojo, Teófilo; López, Gregorio; García, Gabriel; Santana, Ma Dolores
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 32
• Pages of publication: 3906 - 3911
• a: 11.0176 ± 0.0007 Å
• b: 30.997 ± 0.002 Å
• c: 12.4487 ± 0.0008 Å
• α: 90°
• β: 93.409 ± 0.001°
• γ: 90°
• Cell volume: 4243.9 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0626
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.1147
• Weighted residual factors for all reflections included in the refinement: 0.1231
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No