Information card for entry 7045011

Structure parameters

• Formula: C54 H63 P Pd Sn
• Calculated formula: C54 H63 P Pd Sn
• SMILES: [Sn]1c2c([P]([Pd]3[c]4([c]3(cc(cc4C(C)C)C(C)C)C(C)C)c3cccc(c4c(cc(C(C)C)cc4C(C)C)C(C)C)c13)(c1ccccc1)c1ccccc1)cccc2
• Title of publication: Coordination chemistry of stannylene-based Lewis pairs - insertion into M-Cl and M-C bonds. From base stabilized stannylenes to bidentate ligands.
• Authors of publication: Krebs, K. M.; Freitag, S.; Maudrich, J.-J.; Schubert, H.; Sirsch, P.; Wesemann, L.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 47
• Journal issue: 1
• Pages of publication: 83 - 95
• a: 11.8542 ± 0.0003 Å
• b: 29.1032 ± 0.0007 Å
• c: 13.0527 ± 0.0003 Å
• α: 90°
• β: 96.122 ± 0.001°
• γ: 90°
• Cell volume: 4477.44 ± 0.19 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0469
• Residual factor for significantly intense reflections: 0.0292
• Weighted residual factors for significantly intense reflections: 0.0574
• Weighted residual factors for all reflections included in the refinement: 0.0625
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No