Information card for entry 7129998

Structure parameters

• Chemical name: 10,10-diphenyl-5,10-dihydrodibenzo[b,e][1,4]azagermine
• Formula: C24 H19 Ge N
• Calculated formula: C24 H19 Ge N
• SMILES: [Ge]1(c2ccccc2Nc2c1cccc2)(c1ccccc1)c1ccccc1
• Title of publication: Dual-Photofunctional Organogermanium Compound Based on Donor–Acceptor–Donor Architecture
• Authors of publication: Nyga, Aleksandra; Kaihara, Takahito; Hosono, Takumi; Sipala, Massimiliano; Stachelek, Partycja; Tonai, Norimitsu; Minakata, Satoshi; de Sousa, Leonardo E.; de Silva, Piotr; Data, Przemyslaw; Takeda, Youhei
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 10.8997 ± 0.00013 Å
• b: 8.57542 ± 0.0001 Å
• c: 20.1183 ± 0.0002 Å
• α: 90°
• β: 92.5617 ± 0.001°
• γ: 90°
• Cell volume: 1878.57 ± 0.04 ų
• Cell temperature: 213 K
• Ambient diffraction temperature: 213 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0344
• Residual factor for significantly intense reflections: 0.0322
• Weighted residual factors for significantly intense reflections: 0.0915
• Weighted residual factors for all reflections included in the refinement: 0.0932
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No