Information card for entry 7020245

Structure parameters

• Formula: C48 H111 Ga3 N4
• Calculated formula: C48 H111 Ga3 N4
• SMILES: CC([Ga](C(C)(C)C)([N](C)(C)CCN(CC[N](C)(C)[Ga](C(C)(C)C)(C(C)(C)C)C(C)(C)C)CC[N](C)(C)[Ga](C(C)(C)C)(C(C)(C)C)C(C)(C)C)C(C)(C)C)(C)C
• Title of publication: Accessing low denticity coordination modes of a high denticity tripodal ligand to complete its coordinative repertoire.
• Authors of publication: Cadenbach, Thomas; Hevia, Eva; Kennedy, Alan R.; Mulvey, Robert E.; Pickrell, Janie-Anne; Robertson, Stuart D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 34
• Pages of publication: 10141 - 10144
• a: 15.1685 ± 0.0003 Å
• b: 15.1685 ± 0.0003 Å
• c: 14.0288 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2795.35 ± 0.1 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 4
• Space group number: 173
• Hermann-Mauguin space group symbol: P 63
• Hall space group symbol: P 6c
• Residual factor for all reflections: 0.0414
• Residual factor for significantly intense reflections: 0.0322
• Weighted residual factors for significantly intense reflections: 0.0674
• Weighted residual factors for all reflections included in the refinement: 0.0715
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No