Information card for entry 7006670

Structure parameters

• Formula: C49 H33 N4
• Calculated formula: C49 H26 N4
• Title of publication: Derivatives of dipyrido[3,2-a:2',3'-c]phenazine and its ruthenium complexes, influence of arylic substitution on photophysical properties.
• Authors of publication: Schäfer, Bernhard; Görls, Helmar; Presselt, Martin; Schmitt, Michael; Popp, Jürgen; Henry, William; Vos, Johannes G.; Rau, Sven
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 18
• Pages of publication: 2225 - 2231
• a: 11.3762 ± 0.0006 Å
• b: 12.7563 ± 0.0007 Å
• c: 13.6865 ± 0.0005 Å
• α: 97.221 ± 0.003°
• β: 102.933 ± 0.003°
• γ: 110.078 ± 0.002°
• Cell volume: 1773.07 ± 0.16 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 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: 0.1527
• Residual factor for significantly intense reflections: 0.0895
• Weighted residual factors for significantly intense reflections: 0.2433
• Weighted residual factors for all reflections included in the refinement: 0.2938
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No