Information card for entry 1517227

Structure parameters

• Formula: C23 H19 Cl2 N3
• Calculated formula: C23 H19 Cl2 N3
• SMILES: Clc1cc2[C@]3(c4c(cn(c4)C)c4c([C@H]3N(c2cc1)C)[nH]c1c4cc(Cl)cc1)C
• Title of publication: Indimicins A-E, Bisindole Alkaloids from the Deep-Sea-Derived Streptomyces sp. SCSIO 03032.
• Authors of publication: Zhang, Wenjun; Ma, Liang; Li, Sumei; Liu, Zhong; Chen, Yuchan; Zhang, Haibo; Zhang, Guangtao; Zhang, Qingbo; Tian, Xinpeng; Yuan, Chengshan; Zhang, Si; Zhang, Weimin; Zhang, Changsheng
• Journal of publication: Journal of natural products
• Year of publication: 2014
• Journal volume: 77
• Journal issue: 8
• Pages of publication: 1887
• a: 9.5701 ± 0.0004 Å
• b: 7.9131 ± 0.0003 Å
• c: 13.6352 ± 0.0006 Å
• α: 90°
• β: 108.404 ± 0.005°
• γ: 90°
• Cell volume: 979.77 ± 0.08 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0373
• Residual factor for significantly intense reflections: 0.0324
• Weighted residual factors for significantly intense reflections: 0.0787
• Weighted residual factors for all reflections included in the refinement: 0.0822
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No