Information card for entry 7712221

Structure parameters

• Formula: C5 H14 Br2.97 Cl1.03 N2 O Pb
• Calculated formula: C5 H14 Br2.971 Cl1.029 N2 O Pb
• Title of publication: Substituents Make a Difference: 6,6’’-modified Terpyridine Complexes with Helix Configuration and Enhanced Emission
• Authors of publication: Fu, Fan; Liu, Die; Zhao, Lili; Li, Huili; Bai, Xinyu; Chen, Mingzhao; Jiang, Zhilong; Su, Peiyang; Zhong, Wanying; Li, Yiming; Liao, Wei-Ming; He, Jun; Wang, Pingshan
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 6.1544 ± 0.0003 Å
• b: 14.5977 ± 0.0006 Å
• c: 16.1823 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1453.82 ± 0.11 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.059
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.1106
• Weighted residual factors for all reflections included in the refinement: 0.1205
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No