Information card for entry 2227243

Structure parameters

• Chemical name: <i>catena</i>-Poly[{μ-η^5^:η^5^-1-[2-(dimethylamino)ethyl- κ<i>N</i>]cyclopentadienyl}-lithium(I)-(μ-1,1,3,3-tetra-<i>tert</i>- butyltriphosphane-κ^3^<i>P</i>^2^:<i>P</i>^1^,<i>P</i>^3^)lithium(I)]
• Formula: C25 H50 Li2 N P3
• Calculated formula: C25 H50 Li2 N P3
• SMILES: [Li]12345(P([P]6(C(C)(C)C)C(C)(C)C)[P](C(C)(C)C)(C(C)(C)C)[Li]6)[c]6([cH]1[cH]2[cH]3[CH]46)CC[N]5(C)C
• Title of publication: <i>catena</i>-Poly[{μ-η^5^:η^5^-1-[2-(dimethylamino)ethyl-κ<i>N</i>]cyclopentadienyl}-lithium(I)-(μ-1,1,3,3-tetra-<i>tert</i>-butyltriphosphane-κ^3^<i>P</i>^2^:<i>P</i>^1^,<i>P</i>^3^)lithium(I)]
• Authors of publication: Grubba, Rafal; Chojnacki, Jaroslaw; Pikies, Jerzy
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 11
• Pages of publication: m1403
• a: 8.9063 ± 0.0006 Å
• b: 18.8522 ± 0.0008 Å
• c: 19.3934 ± 0.0017 Å
• α: 90°
• β: 115.314 ± 0.006°
• γ: 90°
• Cell volume: 2943.5 ± 0.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• 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: 0.1302
• Residual factor for significantly intense reflections: 0.0953
• Weighted residual factors for significantly intense reflections: 0.2357
• Weighted residual factors for all reflections included in the refinement: 0.2584
• Goodness-of-fit parameter for all reflections included in the refinement: 1.13
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes