Information card for entry 7029087

Structure parameters

• Formula: C34 H50 Cl4 N10 Ni2 O4
• Calculated formula: C34 H50 Cl4 N10 Ni2 O4
• Title of publication: Binding multidentate ligands to Ni(2+): kinetic identification of preferential binding sites.
• Authors of publication: Nartop, Dilek; Clegg, William; Harrington, Ross W.; Henderson, Richard A.; Wills, Corinne Y.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 8
• Pages of publication: 3372 - 3382
• a: 9.2913 ± 0.0005 Å
• b: 10.2003 ± 0.0005 Å
• c: 12.0495 ± 0.0007 Å
• α: 83.85 ± 0.004°
• β: 67.556 ± 0.005°
• γ: 82.657 ± 0.004°
• Cell volume: 1044.7 ± 0.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.0289
• Residual factor for significantly intense reflections: 0.0236
• Weighted residual factors for significantly intense reflections: 0.0598
• Weighted residual factors for all reflections included in the refinement: 0.0609
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No