Information card for entry 4060384

Structure parameters

• Formula: C12 H15 P S2
• Calculated formula: C12 H15 P S2
• SMILES: [P]1(SCC(=C(C1)C)C)(=S)c1ccccc1
• Title of publication: 2,3-Benzo-7-phosphanorbornadiene Complexes: Synthesis and Chemistry
• Authors of publication: Compain, Carine; Donnadieu, Bruno; Mathey, François
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 7
• Pages of publication: 1762 - 1765
• a: 11.5733 ± 0.0012 Å
• b: 6.8944 ± 0.0007 Å
• c: 15.7794 ± 0.0016 Å
• α: 90°
• β: 95.682 ± 0.005°
• γ: 90°
• Cell volume: 1252.9 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Duplicate of: 4060382
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No