Information card for entry 7100989

Structure parameters

• Formula: C22 H23 F6 N2 P Pd
• Calculated formula: C22 H23 F6 N2 P Pd
• SMILES: C1C(=[CH2][Pd]21[N](=C1C(c3c4c1cccc4ccc3)=[N]2C1CC1)C1CC1)C.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Using Ring Strain to Inhibit a Decomposition Path: First Synthesis of an Alkyl-BIAN ligand (Alkyl-BIAN = bis(alkyl) -acenaphthenequinonediimine)
• Authors of publication: Fabio Ragaini; Emma Gallo; Michela Gasperini; Piero Macchi
• Journal of publication: Chemical Communications
• Year of publication: 2005
• a: 8.6005 ± 0.0014 Å
• b: 13.217 ± 0.002 Å
• c: 18.918 ± 0.003 Å
• α: 90°
• β: 91.575 ± 0.004°
• γ: 90°
• Cell volume: 2149.6 ± 0.6 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No