Information card for entry 7050208

Structure parameters

• Formula: C23 H18 Ga I3 N4
• Calculated formula: C23 H18 Ga I3 N4
• SMILES: I[Ga]12(I)[n]3ccccc3c3[n]1c(cc(c3)c1ccccc1)c1[n]2cccc1.[I-].N#CC
• Title of publication: The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes
• Authors of publication: Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2004
• Journal volume: 28
• Journal issue: 2
• Pages of publication: 207
• a: 7.357 ± 0.0015 Å
• b: 13.306 ± 0.003 Å
• c: 13.759 ± 0.003 Å
• α: 99.44 ± 0.03°
• β: 97.59 ± 0.03°
• γ: 102.53 ± 0.03°
• Cell volume: 1277.2 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0801
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.0857
• Weighted residual factors for all reflections included in the refinement: 0.097
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No