Information card for entry 7710050

Structure parameters

• Chemical name: bis(di-tert-butylindenyl)plumbocene
• Formula: C34 H46 Pb
• Calculated formula: C34 H46 Pb
• SMILES: [Pb]12345678([cH]9[c]1([c]12[c]3(cccc1)[c]49C(C)(C)C)C(C)(C)C)[cH]1[c]8([c]27[c]6([c]51C(C)(C)C)cccc2)C(C)(C)C
• Title of publication: Bis(di-<i>tert</i>-butylindenyl)tetrelocenes.
• Authors of publication: Staub, Liane Hildegard; Lambert, Jessica; Müller, Carsten; Morgenstern, Bernd; Zimmer, Michael; Warken, Joshua; Koldemir, Aylin; Block, Theresa; Pöttgen, Rainer; Schäfer, André
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2022
• a: 11.1603 ± 0.0004 Å
• b: 14.9272 ± 0.0005 Å
• c: 18.8917 ± 0.0007 Å
• α: 90°
• β: 106.198 ± 0.001°
• γ: 90°
• Cell volume: 3022.27 ± 0.19 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.029
• Residual factor for significantly intense reflections: 0.019
• Weighted residual factors for significantly intense reflections: 0.0377
• Weighted residual factors for all reflections included in the refinement: 0.0408
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No