Information card for entry 7709479

Structure parameters

• Formula: C12 H12 Bi Cl4 N3 O
• Calculated formula: C12 H10 Bi Cl4 N3
• Title of publication: Inserting protonated phenanthroline derivatives to interchain voids of anionic halometallate units to generate hybrid materials with tunable photochromic performance
• Authors of publication: Li, Gang-Mei; Liang, Zhen-Gang; Xue, Zhenzhen; Han, Song-De; Pan, Jie; Wang, Guo-Ming
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 7.2209 ± 0.0004 Å
• b: 10.1824 ± 0.0009 Å
• c: 12.1346 ± 0.0008 Å
• α: 93.11 ± 0.006°
• β: 104.131 ± 0.005°
• γ: 109.667 ± 0.007°
• Cell volume: 805.6 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.069
• Residual factor for significantly intense reflections: 0.0508
• Weighted residual factors for significantly intense reflections: 0.1333
• Weighted residual factors for all reflections included in the refinement: 0.1403
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No