Information card for entry 2101007

Structure parameters

• Formula: C26 H20 O4
• Calculated formula: C26 O4
• SMILES: O(C(=O)[C@@]12c3ccccc3[C@H]3c4ccccc4[C@@]1([C@@]23C(=O)OC)c1ccccc1)C.O(C(=O)[C@]12c3ccccc3[C@@H]3c4ccccc4[C@]1([C@]23C(=O)OC)c1ccccc1)C
• Title of publication: Crystal structure correlations in the photochemistry of dimethyl 9-phenyl-9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylate
• Authors of publication: Pokkuluri, P. R.; Scheffer, J. R.; Trotter, J.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 4
• Pages of publication: 754 - 760
• a: 10.206 ± 0.003 Å
• b: 16.485 ± 0.001 Å
• c: 11.758 ± 0.004 Å
• α: 90°
• β: 95.48 ± 0.02°
• γ: 90°
• Cell volume: 1969.2 ± 0.9 ų
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: Cu
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No