Information card for entry 1553287

Structure parameters

• Formula: C15 H24 N2 O
• Calculated formula: C15 H24 N2 O
• SMILES: O=C1N2[C@@H]3[C@@H](CCC[C@H]3CN3[C@H]2CCCC3)CC1.O=C1N2[C@H]3[C@H](CCC[C@@H]3CN3[C@@H]2CCCC3)CC1
• Title of publication: Alkaloids with Different Carbon Units from Myrioneuron faberi.
• Authors of publication: Cao, Ming-Ming; Zhang, Yu; Huang, Sheng-Dian; Di, Ying-Tong; Peng, Zong-Gen; Jiang, Jian-Dong; Yuan, Chun-Mao; Chen, Duo-Zhi; Li, Shun-Lin; He, Hong-Ping; Hao, Xiao-Jiang
• Journal of publication: Journal of natural products
• Year of publication: 2015
• Journal volume: 78
• Journal issue: 11
• Pages of publication: 2609 - 2616
• a: 8.8466 ± 0.0002 Å
• b: 9.1188 ± 0.0002 Å
• c: 9.5971 ± 0.0002 Å
• α: 95.094 ± 0.001°
• β: 112.717 ± 0.001°
• γ: 112.004 ± 0.001°
• Cell volume: 636.97 ± 0.03 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0515
• Residual factor for significantly intense reflections: 0.0514
• Weighted residual factors for significantly intense reflections: 0.1481
• Weighted residual factors for all reflections included in the refinement: 0.1483
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No