Information card for entry 7124068

Structure parameters

• Formula: C16 H9 N O S2
• Calculated formula: C16 H9 N O S2
• Title of publication: Carbazole-Containing Porphyrinoid and its Oligomers
• Authors of publication: Song, Jianxin; Wu, Tongjing; Kim, Taeyeon; Yin, Bangshao; Wang, Kaisheng; Xu, Ling; Zhou, Mingbo; Kim, Dongho
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 15.7517 ± 0.0007 Å
• b: 9.3641 ± 0.0003 Å
• c: 17.765 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2620.35 ± 0.18 ų
• Cell temperature: 120 ± 0.1 K
• Ambient diffraction temperature: 120 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0554
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.085
• Weighted residual factors for all reflections included in the refinement: 0.0933
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No