Information card for entry 7007621

Structure parameters

• Formula: C66 H82 Cl2 In2 N4
• Calculated formula: C66 H82 Cl2 In2 N4
• SMILES: C1=[N]([In](N(C=C1c1ccccc1)c1c(cccc1C(C)C)C(C)C)(Cl)[In]1(N(C=C(C=[N]1c1c(cccc1C(C)C)C(C)C)c1ccccc1)c1c(cccc1C(C)C)C(C)C)Cl)c1c(C(C)C)cccc1C(C)C
• Title of publication: The beta-dialdiminato ligand [{N(C6H3Pri(2)-2,6)C(H)}2CPh]-: the conjugate acid and Li, Al, Ga and In derivatives.
• Authors of publication: Cheng, Yanxiang; Doyle, David J.; Hitchcock, Peter B.; Lappert, Michael F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 37
• Pages of publication: 4449 - 4460
• a: 12.3372 ± 0.0005 Å
• b: 12.3604 ± 0.0006 Å
• c: 12.9731 ± 0.0004 Å
• α: 92.242 ± 0.002°
• β: 118.216 ± 0.002°
• γ: 111.648 ± 0.002°
• Cell volume: 1564.23 ± 0.12 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0472
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.0821
• Weighted residual factors for all reflections included in the refinement: 0.0869
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No