Information card for entry 4075336

Structure parameters

• Common name: Holmiumocene
• Chemical name: tris-cyclopentadienyl-holmium(III)
• Formula: C15 H15 Ho
• Calculated formula: C15 H15 Ho
• SMILES: [Ho]123456789%10%11%12([cH]%13[cH]2[cH]3[cH]4[cH]1%13)([cH]1[cH]6[cH]5[cH]8[cH]71)[cH]1[cH]9[cH]%10[cH]%11[cH]%121
• Title of publication: Synthesis, Structure, and Dynamics of Tris(η5-cyclopentadienyl)lanthanides and Bis(η5-cyclopentadienyl)[bis(trimethylsilyl)amido]cerium(III)
• Authors of publication: Baisch, Ulrich; Pagano, Sandro; Zeuner, Martin; Schmedt auf der Günne, Jörn; Oeckler, Oliver; Schnick, Wolfgang
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 12
• Pages of publication: 3027
• a: 8.4303 ± 0.0017 Å
• b: 14.085 ± 0.003 Å
• c: 19.407 ± 0.004 Å
• α: 90°
• β: 90.02 ± 0.03°
• γ: 90°
• Cell volume: 2304.4 ± 0.8 ų
• Cell temperature: 130 K
• Ambient diffraction temperature: 130 K
• Number of distinct elements: 3
• 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: 0.0294
• Residual factor for significantly intense reflections: 0.0231
• Weighted residual factors for significantly intense reflections: 0.0415
• Weighted residual factors for all reflections included in the refinement: 0.0428
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No