Information card for entry 4338694

Structure parameters

• Formula: C76 H92 N16 Ni2 O14
• Calculated formula: C76 H92 N16 Ni2 O14
• Title of publication: Cobalt, zinc, and nickel complexes of a diatopic heteroscorpionate ligand: building blocks for coordination polymers.
• Authors of publication: Santillan, Guillermo A.; Carrano, Carl J.
• Journal of publication: Inorganic chemistry
• Year of publication: 2008
• Journal volume: 47
• Journal issue: 3
• Pages of publication: 930 - 939
• a: 9.38 ± 0.003 Å
• b: 20.191 ± 0.006 Å
• c: 21.026 ± 0.006 Å
• α: 90.148 ± 0.014°
• β: 91.88 ± 0.014°
• γ: 94.905 ± 0.016°
• Cell volume: 3965 ± 2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.1386
• Residual factor for significantly intense reflections: 0.0719
• Weighted residual factors for significantly intense reflections: 0.2439
• Weighted residual factors for all reflections included in the refinement: 0.2977
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No