Information card for entry 7703121

Structure parameters

• Formula: C59 H67 Cl N O2 P Ti
• Calculated formula: C59 H67 Cl N O2 P Ti
• Title of publication: Synthesis and structures of titanium complexes bearing tetradentate tripodal [O₂XC] ligands (X = C, P).
• Authors of publication: Nakanishi, Yusuke; Ishida, Yutaka; Kawaguchi, Hiroyuki
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 1
• Pages of publication: 27 - 30
• a: 11.9944 ± 0.0002 Å
• b: 13.2152 ± 0.0002 Å
• c: 17.0702 ± 0.0003 Å
• α: 79.141 ± 0.001°
• β: 80.483 ± 0.001°
• γ: 84.749 ± 0.001°
• Cell volume: 2615.65 ± 0.08 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0578
• Residual factor for significantly intense reflections: 0.0407
• Weighted residual factors for significantly intense reflections: 0.0997
• Weighted residual factors for all reflections included in the refinement: 0.1083
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No