Information card for entry 7031397

Structure parameters

• Formula: C36 H56 N10 Na2 O2
• Calculated formula: C36 H56 N10 Na2 O2
• SMILES: C[N]1(C)CC[O](CCN(C)C)[Na]2341[N]1(c5cccc[n]25)c2[n](cccc2)[Na]125([N](CC[O]5CCN(C)C)(C)C)[n]1c([N]23c2cccc[n]24)cccc1
• Title of publication: Donor-activated alkali metal dipyridylamides: co-complexation reactions with zinc alkyls and reactivity studies with benzophenone.
• Authors of publication: Armstrong, David R.; Brouillet, Etienne V.; Kennedy, Alan R.; Garden, Jennifer A.; Granitzka, Markus; Mulvey, Robert E.; Trivett, Joshua J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 38
• Pages of publication: 14409 - 14423
• a: 15.8743 ± 0.0008 Å
• b: 12.4146 ± 0.0007 Å
• c: 19.8597 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3913.8 ± 0.4 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 29
• Hermann-Mauguin space group symbol: P b c 21
• Hall space group symbol: P 2c -2b
• Residual factor for all reflections: 0.1119
• Residual factor for significantly intense reflections: 0.0769
• Weighted residual factors for significantly intense reflections: 0.197
• Weighted residual factors for all reflections included in the refinement: 0.2266
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No