Information card for entry 7020244

Structure parameters

• Formula: C20 H48 N4 Zn
• Calculated formula: C20 H48 N4 Zn
• SMILES: [Zn]1(C(C)(C)C)(C(C)(C)C)[N](C)(C)CC[N]1(CCN(C)C)CCN(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: 8.915 ± 0.0003 Å
• b: 11.3744 ± 0.0005 Å
• c: 13.6985 ± 0.0006 Å
• α: 66.433 ± 0.004°
• β: 77.519 ± 0.003°
• γ: 72.686 ± 0.004°
• Cell volume: 1208.01 ± 0.09 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.029
• Residual factor for significantly intense reflections: 0.0246
• Weighted residual factors for significantly intense reflections: 0.059
• Weighted residual factors for all reflections included in the refinement: 0.061
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No