Information card for entry 7703799

Structure parameters

• Formula: C12 H12 Bi Br3 N2
• Calculated formula: C12 H12 Bi Br3 N2
• Title of publication: Sb- and Bi-based coordination polymers with N-donor ligands with and without lone-pair effects and their photoluminescence properties.
• Authors of publication: Sorg, Jens R.; Schneider, Tilman; Wohlfarth, Luise; Schäfer, Thomas C; Sedykh, Alexander; Müller-Buschbaum, Klaus
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 15
• Pages of publication: 4904 - 4913
• a: 8.9483 ± 0.0004 Å
• b: 9.4511 ± 0.0004 Å
• c: 10.5223 ± 0.0006 Å
• α: 69.645 ± 0.003°
• β: 70.592 ± 0.003°
• γ: 78.476 ± 0.002°
• Cell volume: 783.33 ± 0.07 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0478
• Residual factor for significantly intense reflections: 0.0361
• Weighted residual factors for significantly intense reflections: 0.081
• Weighted residual factors for all reflections included in the refinement: 0.0872
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No