Information card for entry 2311340

Structure parameters

• Chemical name: Bis(η^5^-cyclopentadienyl)(3-cyclopropyl-<i>N</i>,<i>N</i>'-diisopropylpropynamidinato-κ^2^<i>N</i>,<i>N</i>')ytterbium(III)
• Formula: C22 H29 N2 Yb
• Calculated formula: C22 H29 N2 Yb
• SMILES: C1(C#CC2CC2)=[N](C(C)C)[Yb]23456789([cH]%10[cH]3[cH]4[cH]5[cH]6%10)([cH]3[cH]7[cH]8[cH]9[cH]23)N1C(C)C
• Title of publication: Crystal structures of two ytterbium(III) complexes comprising alkynylamidinate ligands.
• Authors of publication: Wang, Sida; Sroor, Farid M.; Liebing, Phil; Lorenz, Volker; Hilfert, Liane; Edelmann, Frank T.
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2016
• Journal volume: 72
• Journal issue: Pt 9
• Pages of publication: 1229 - 1233
• a: 9.4578 ± 0.0002 Å
• b: 19.291 ± 0.0006 Å
• c: 22.2114 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4052.48 ± 0.18 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0291
• Residual factor for significantly intense reflections: 0.0184
• Weighted residual factors for significantly intense reflections: 0.0379
• Weighted residual factors for all reflections included in the refinement: 0.0399
• Goodness-of-fit parameter for all reflections included in the refinement: 0.976
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No