Information card for entry 7051463

Structure parameters

• Formula: C32 H41 Cl N P2 S Tc
• Calculated formula: C32 H41 Cl N P2 S Tc
• SMILES: [Tc]1(Cl)(SCC[P]1(C1CCCCC1)C1CCCCC1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)#N
• Journal of publication: New Journal of Chemistry
• Year of publication: 1999
• a: 12.437 ± 0.004 Å
• b: 13.441 ± 0.004 Å
• c: 19.06 ± 0.006 Å
• α: 90°
• β: 102.05 ± 0.03°
• γ: 90°
• Cell volume: 3116 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0433
• Weighted residual factors for significantly intense reflections: 0.0993
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No