Information card for entry 7133679

Structure parameters

• Formula: C44 H53 Cl6 N7 Ni O
• Calculated formula: C44 H53 Cl6 N7 Ni O
• Title of publication: Synthesis and characterization of tetrapodal nickel complexes with adaptable ligand binding geometries.
• Authors of publication: Cho, Hsien-Liang; Gullett, Kelly L.; Fout, Alison R.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 76
• Pages of publication: 10564 - 10567
• a: 12.6855 ± 0.0004 Å
• b: 13.1657 ± 0.0004 Å
• c: 13.8011 ± 0.0005 Å
• α: 90.462 ± 0.002°
• β: 93.57 ± 0.002°
• γ: 100.75 ± 0.002°
• Cell volume: 2259.67 ± 0.13 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0946
• Residual factor for significantly intense reflections: 0.0691
• Weighted residual factors for significantly intense reflections: 0.181
• Weighted residual factors for all reflections included in the refinement: 0.209
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No