Information card for entry 7015883

Structure parameters

• Common name: bis-(N,N'-dicyclohexylneopentylamidinato-iodo-gallium(ii)) - N,N'-dicyclohexylneopentylamidinato-gallium(i) toluene solvate
• Chemical name: bis-(N,N'-dicyclohexylneopentylamidinato-iodo-gallium(II)) -N,N'-dicyclohexylneopentylamidinato-gallium(I) toluene solvate
• Formula: C58 H101 Ga3 I2 N6
• Calculated formula: C58 H101 Ga3 I2 N6
• SMILES: I[Ga]1([Ga]2([Ga]3(I)[N](=C(N3C3CCCCC3)C(C)(C)C)C3CCCCC3)[N](=C(N2C2CCCCC2)C(C)(C)C)C2CCCCC2)[N](=C(N1C1CCCCC1)C(C)(C)C)C1CCCCC1.c1(ccccc1)C
• Title of publication: Synthesis, structure and reactions of an amidinate stabilised trigallane.
• Authors of publication: Linti, Gerald; Zessin, Thomas
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 20
• Pages of publication: 5591 - 5598
• a: 12.912 ± 0.003 Å
• b: 16.09 ± 0.003 Å
• c: 16.506 ± 0.003 Å
• α: 78.66 ± 0.03°
• β: 85.66 ± 0.03°
• γ: 71.01 ± 0.03°
• Cell volume: 3179 ± 1.3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.1697
• Residual factor for significantly intense reflections: 0.0545
• Weighted residual factors for significantly intense reflections: 0.1113
• Weighted residual factors for all reflections included in the refinement: 0.1406
• Goodness-of-fit parameter for all reflections included in the refinement: 0.718
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No