Information card for entry 7233936

Structure parameters

• Formula: C52 H36 Cl2 N4
• Calculated formula: C52 H36 Cl2 N4
• SMILES: N1(c2c3ccccc3c3ccccc3c2N(c2ccccc12)c1ccc(cc1)c1ccc(cc1)c1n(c2ccccc2n1)c1ccccc1)c1ccccc1.C(Cl)Cl
• Title of publication: Novel hole transport materials based on N,N'-disubstituted-dihydrophenazine derivatives for electroluminescent diodes
• Authors of publication: Zhiwen Zheng; Qingchen Dong; Liao Gou; Jian-Hua Su; Jinhai Huang
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2014
• Journal volume: 2
• Pages of publication: 9858 - 9865
• a: 9.4937 ± 0.0015 Å
• b: 10.0154 ± 0.0016 Å
• c: 21.812 ± 0.004 Å
• α: 101.429 ± 0.004°
• β: 97.164 ± 0.005°
• γ: 104.122 ± 0.003°
• Cell volume: 1938.4 ± 0.6 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 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: 0.1312
• Residual factor for significantly intense reflections: 0.0755
• Weighted residual factors for significantly intense reflections: 0.1931
• Weighted residual factors for all reflections included in the refinement: 0.2283
• Goodness-of-fit parameter for all reflections included in the refinement: 0.962
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No