Information card for entry 7235851

Structure parameters

• Formula: C30 H41 N O5
• Calculated formula: C30 H41 N O5
• Title of publication: Multiple linker half-squarylium dyes for dye-sensitized solar cells; are two linkers better than one?
• Authors of publication: Connell, Arthur; Holliman, Peter J.; Jones, Eurig W.; Furnell, Leo; Kershaw, Christopher; Davies, Matthew L.; Gwenin, Christopher D.; Pitak, Mateusz B.; Coles, Simon J.; Cooke, Graeme
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2015
• Journal volume: 3
• Journal issue: 6
• Pages of publication: 2883
• a: 9.8804 ± 0.0017 Å
• b: 16.659 ± 0.003 Å
• c: 18.091 ± 0.003 Å
• α: 75.447 ± 0.001°
• β: 81.26 ± 0.011°
• γ: 74.709 ± 0.009°
• Cell volume: 2768.4 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1022
• Residual factor for significantly intense reflections: 0.0646
• Weighted residual factors for significantly intense reflections: 0.1548
• Weighted residual factors for all reflections included in the refinement: 0.1746
• Goodness-of-fit parameter for all reflections included in the refinement: 0.886
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No