Information card for entry 7017997

Structure parameters

• Formula: C24 H29 K O
• Calculated formula: C24 H29 K O
• SMILES: [K][O]1CCCC1.c1(c(c(c([c-]1Cc1cccc2ccccc12)C)C)C)C
• Title of publication: A naphthyl-substituted pentamethylcyclopentadienyl ligand and its Sm(II) bent-metallocene complexes with solvent-induced structure change.
• Authors of publication: Yatabe, Takeshi; Karasawa, Masaki; Isobe, Kiyoshi; Ogo, Seiji; Nakai, Hidetaka
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 2
• Pages of publication: 354 - 356
• a: 14.092 ± 0.002 Å
• b: 10.4839 ± 0.0015 Å
• c: 15.135 ± 0.002 Å
• α: 90°
• β: 109.337 ± 0.0011°
• γ: 90°
• Cell volume: 2109.9 ± 0.5 ų
• Cell temperature: 123.1 K
• Ambient diffraction temperature: 123.1 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0642
• Weighted residual factors for all reflections included in the refinement: 0.2101
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No