Information card for entry 4060977

Structure parameters

• Formula: C10 H20 Cu F6 N2 P S2
• Calculated formula: C10 H20 Cu F6 N2 P S2
• Title of publication: Copper Complexes with N-Alkylated NS~2~-Macrocyclic Ligands: Synthesis, Characterization, and Capabilities as Aziridination Precatalysts
• Authors of publication: Conry ,Rebecca R.; Tipton, A. Alex; Striejewske, William S.; Erkizia, Edurne; Malwitz, Mark A.; Caffaratti, Angela; Natkin, Jonathan A.
• Journal of publication: Organometallics
• Year of publication: 2004
• Journal volume: 23
• Journal issue: 22
• Pages of publication: 5210 - 5218
• a: 15.917 ± 0.002 Å
• b: 30.197 ± 0.004 Å
• c: 7.3647 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3539.7 ± 0.7 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 7
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.1352
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No