Information card for entry 4073092

Structure parameters

• Formula: C22 H33 F6 N2 Pd S Sb
• Calculated formula: C22 H33 F6 N2 Pd S Sb
• SMILES: [Pd]123([S]([C@H]([C@@H](n4c=1n1c(c4)cccc1)C)C(C)C)C1CCCCC1)C[CH]2=[CH2]3.[Sb](F)(F)(F)(F)([F-])F.[Pd]123([S]([C@@H]([C@H](n4c=1n1c(c4)cccc1)C)C(C)C)C1CCCCC1)C[CH]2=[CH2]3.[Sb](F)(F)(F)(F)([F-])F
• Title of publication: Imidazo[1,5-a]pyridin-3-ylidene/Thioether Mixed C/S Ligands and Complexes Thereof§
• Authors of publication: Roseblade, Stephen J.; Ros, Abel; Monge, David; Alcarazo, Manuel; Álvarez, Eleuterio; Lassaletta, José M.; Fernández, Rosario
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 10
• Pages of publication: 2570
• a: 9.5909 ± 0.0003 Å
• b: 11.2097 ± 0.0003 Å
• c: 13.6304 ± 0.0004 Å
• α: 66.284 ± 0.002°
• β: 73.418 ± 0.002°
• γ: 76.76 ± 0.002°
• Cell volume: 1274.92 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0929
• Residual factor for significantly intense reflections: 0.0488
• Weighted residual factors for significantly intense reflections: 0.0976
• Weighted residual factors for all reflections included in the refinement: 0.1155
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No