Information card for entry 1502139

Structure parameters

• Common name: 6,10-dimethyl-15b-phosphanaphtho[1,8-ab]perylene
• Formula: C28 H19 P
• Calculated formula: C28 H19 P
• SMILES: c12c3cccc1c1c4c(P2c2c5c3c(ccc5ccc2)C)cccc4ccc1C
• Title of publication: Tandem phospha-Friedel-Crafts reaction toward curved π-conjugated frameworks with a phosphorus ring junction.
• Authors of publication: Hatakeyama, Takuji; Hashimoto, Sigma; Nakamura, Masaharu
• Journal of publication: Organic letters
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 8
• Pages of publication: 2130 - 2133
• a: 11.8709 ± 0.0017 Å
• b: 18.0107 ± 0.0017 Å
• c: 9.9332 ± 0.0015 Å
• α: 90°
• β: 117.349 ± 0.0087°
• γ: 90°
• Cell volume: 1886.4 ± 0.5 ų
• Cell temperature: 80 K
• Ambient diffraction temperature: 80 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 1.3 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No