Information card for entry 4021124

Structure parameters

• Formula: C22 H37 N O4 Si
• Calculated formula: C22 H37 N O4 Si
• SMILES: O1N(O[Si](C(C)(C)C)(C)C)[C@]([C@H](CC1(C)C)c1ccccc1)(CC(=O)OC)C.O1N(O[Si](C(C)(C)C)(C)C)[C@@]([C@@H](CC1(C)C)c1ccccc1)(CC(=O)OC)C
• Title of publication: New C-C Coupling Reaction of Cyclic Nitronates with Carbon Nucleophiles. Umpolung of the Conventional Reactivity of Nitronates
• Authors of publication: Vladimir O. Smirnov; Sema L. Ioffe; Alexander A. Tishkov; Yulia A. Khomutova; Ivan D. Nesterov; Michael Yu. Antipin; William A. Smit; Vladimir A. Tartakovsky
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 8485 - 8488
• a: 9.423 ± 0.002 Å
• b: 9.858 ± 0.002 Å
• c: 13.376 ± 0.003 Å
• α: 78.856 ± 0.005°
• β: 75.572 ± 0.006°
• γ: 82.53 ± 0.006°
• Cell volume: 1176.3 ± 0.5 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No