Information card for entry 4020892

Structure parameters

• Formula: C97 H124 N6 O18 P2
• Calculated formula: C97 H123 N6 O18 P2
• Title of publication: Diverse Modes of Reactivity of Dialkyl Azodicarboxylates with P(III) Compounds: Synthesis, Structure, and Reactivity of Products Other than the Morrison-Brunn-Huisgen Intermediate in a Mitsunobu-Type Reaction
• Authors of publication: N. Satish Kumar; K. Praveen Kumar; K. V. P. Pavan Kumar; Praveen Kommana; Jagadese J. Vittal; K. C. Kumara Swamy
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 1880 - 1889
• a: 9.6724 ± 0.0008 Å
• b: 11.9518 ± 0.001 Å
• c: 22.0645 ± 0.0019 Å
• α: 80.273 ± 0.002°
• β: 86.782 ± 0.002°
• γ: 73.459 ± 0.002°
• Cell volume: 2409.9 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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