Information card for entry 2101207

Structure parameters

• Chemical name: 6-formyl-1,1,2,3,3,5-hexamethylindan
• Formula: C16 H22 O
• Calculated formula: C16 H22.5 O1.5
• Title of publication: Crystal studies of musk compounds. VIII. Structures of five homologues of musk phantolid
• Authors of publication: De Ridder, Dirk J.A.^3^; Čapková, Pavla^4^; Hatjisymeon, Kostas^5^; Fraanje, Jan; Schenk, Henk
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 5
• Pages of publication: 607 - 616
• a: 8.232 ± 0.004 Å
• b: 9.641 ± 0.001 Å
• c: 18.141 ± 0.003 Å
• α: 78.29 ± 0.01°
• β: 82.93 ± 0.02°
• γ: 89.7 ± 0.03°
• Cell volume: 1398.8 ± 0.7 ų
• Cell temperature: 243 K
• Ambient diffraction temperature: 243 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.09
• Residual factor for significantly intense reflections: 0.09
• Weighted residual factors for all reflections: 0.113
• Weighted residual factors for significantly intense reflections: 0.113
• Goodness-of-fit parameter for all reflections: 0.248
• Goodness-of-fit parameter for significantly intense reflections: 0.248
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No