Information card for entry 4020820

Structure parameters

• Formula: C16 H24 N2 O8
• Calculated formula: C16 H24 N2 O8
• SMILES: O1[C@@]2(C(C)([C@@](CC2)(C1=O)C)C)C(=O)OC[C@](N(=O)=O)(C(N(=O)=O)(C)C)C
• Title of publication: Preparation and Characterization of New Chiral Nitronyl Nitroxides Bearing a Stereogenic Center in the Imidazolyl Framework
• Authors of publication: Satoshi Shimono; Rui Tamura; Naohiko Ikuma; Tatsuya Takimoto; Naoyuki Kawame; Osamu Tamada; Naoko Sakai; Hiroaki Matsuura; Jun Yamauchi
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 475 - 481
• a: 6.3253 ± 0.0004 Å
• b: 13.884 ± 0.001 Å
• c: 10.506 ± 0.001 Å
• α: 90°
• β: 91.63 ± 0.005°
• γ: 90°
• Cell volume: 922.3 ± 0.12 ų
• Cell temperature: 298 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No