Information card for entry 4020854

Structure parameters

• Formula: C33 H32 O8
• Calculated formula: C33 H32 O8
• SMILES: C12(c3c(c4c1ccc(O)c4)cc(O)cc3)c1ccc(O)cc1c1cc(O)ccc21.CCOC(=O)C.CCOC(=O)C
• Title of publication: Molecular Tectonics. Porous Hydrogen-Bonded Networks Built from Derivatives of 9,9'-Spirobifluorene
• Authors of publication: Jean-Hugues Fournier; Thierry Maris; James D. Wuest
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 1762 - 1775
• a: 7.556 ± 0.0003 Å
• b: 11.3326 ± 0.0004 Å
• c: 17.5119 ± 0.0007 Å
• α: 85.896 ± 0.002°
• β: 77.828 ± 0.003°
• γ: 73.671 ± 0.002°
• Cell volume: 1406.57 ± 0.09 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 3
• 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