Information card for entry 7015886

Structure parameters

• Common name: N,N'-dicyclohexylneopentylamidinato-ethyl-gallium(ii)-N,N' - dicyclohexylneopentylamidinato-hydrido-gallium(ii)-N,N' - dicyclohexylneopentylamidinato-gallium(i)
• Chemical name: N,N'-dicyclohexylneopentylamidinato-ethyl-gallium(II)-N,N' -dicyclohexylneopentylamidinato-hydrido-gallium(II)-N,N' -dicyclohexylneopentylamidinato-gallium(I)
• Formula: C53 H99 Ga3 N6
• Calculated formula: C53 H99 Ga3 N6
• SMILES: [GaH]1([Ga]2([Ga]3([N](=C(N3C3CCCCC3)C(C)(C)C)C3CCCCC3)CC)[N](=C(N2C2CCCCC2)C(C)(C)C)C2CCCCC2)[N](=C(N1C1CCCCC1)C(C)(C)C)C1CCCCC1
• 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: 12.634 ± 0.003 Å
• b: 20.821 ± 0.004 Å
• c: 21.296 ± 0.004 Å
• α: 90°
• β: 90.57 ± 0.03°
• γ: 90°
• Cell volume: 5602 ± 2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1995
• Residual factor for significantly intense reflections: 0.0611
• Weighted residual factors for significantly intense reflections: 0.1179
• Weighted residual factors for all reflections included in the refinement: 0.1617
• Goodness-of-fit parameter for all reflections included in the refinement: 0.78
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No