Information card for entry 1543495

Structure parameters

• Common name: Li-CH2P(tBu)2
• Chemical name: Lithium(bis-tert-butyl)phosphanylmethanide
• Formula: C9 H20 Li P
• Calculated formula: C9 H20 Li P
• SMILES: P(C(C)(C)C)(C(C)(C)C)[CH2-].[Li+]
• Title of publication: Donor-unsupported Phosphanylmethanides Li[CH2PR2] (R = tBu, Ph) – Crystal Structure of Li[CH2PtBu2] Solved by XRPD and DFT-D Calculations
• Authors of publication: Samigullin, Kamil; Bodach, Alexander; Wagner, Matthias; Alig, Edith; Fink, Lothar; Lerner, Hans-Wolfram
• Journal of publication: Zeitschrift für anorganische und allgemeine Chemie
• Year of publication: 2016
• Journal volume: 642
• Journal issue: 3
• Pages of publication: 282 - 287
• a: 12.74672 ± 0.00016 Å
• b: 15.92732 ± 0.0002 Å
• c: 10.89957 ± 0.00011 Å
• α: 90°
• β: 90.0415 ± 0.0051°
• γ: 90°
• Cell volume: 2212.84 ± 0.05 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor R(I) for significantly intense reflections: 0.00765
• Goodness-of-fit parameter for all reflections: 1.181
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 1.5406 Å
• Diffraction radiation type: CuKα~1~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No