Information card for entry 5000189

Structure parameters

• Formula: C12 H15 N3 O6
• Calculated formula: C12 H15 N3 O6
• Title of publication: Solid-state photochemistry of nitro compounds: structure-reactivity correlations
• Authors of publication: Padmanabhan, Kaillathe; Döpp, Dietrich; Venkatesan, Kailasam; Ramamurthy, Vaidyanathan
• Journal of publication: Journal of the Chemical Society, Perkin Transactions 2
• Year of publication: 1986
• Journal issue: 6
• Pages of publication: 897 - 906
• a: 9.226 ± 0.001 Å
• b: 11.104 ± 0.001 Å
• c: 14.622 ± 0.002 Å
• α: 90°
• β: 107.79 ± 0.01°
• γ: 90°
• Cell volume: 1426.33 ų
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No