Information card for entry 7103188

Structure parameters

• Common name: 3,6,13,16-tetrabromo-2,7,12,17-tetrapropylporphycene
• Chemical name: 3,6,13,16-tetrabromo-2,7,12,17-tetrapropylporphycene
• Formula: C32 H34 Br4 N4
• Calculated formula: C32 H34 Br4 N4
• Title of publication: Photophysical and photosensitizing properties of brominated porphycenes.
• Authors of publication: Shimakoshi, Hisashi; Baba, Tatsushi; Iseki, Yusuke; Aritome, Isao; Endo, Ayataka; Adachi, Chihaya; Hisaeda, Yoshio
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 25
• Pages of publication: 2882 - 2884
• a: 17.0117 ± 0.001 Å
• b: 8.0919 ± 0.0004 Å
• c: 22.1183 ± 0.0012 Å
• α: 90°
• β: 92.272 ± 0.001°
• γ: 90°
• Cell volume: 3042.3 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0562
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.0944
• Weighted residual factors for all reflections included in the refinement: 0.103
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No