1-benzyl-4-[(5,6-dimethoxy-1-indanon-2-yl)methyl]piperidine (E20) Summary
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- 1-benzyl-4-[(5,6-dimethoxy-1-indanon-2-yl)methyl]piperidine (E20) Summary
- Dihedrals
Dihedrals Table
| Dih. | Atom names | Experimental | Type |
|---|---|---|---|
| 1 | C1.1-C2.2-C3.3-C4.43-2-1-0 C1.4-C2.3-C3.2-C4.1 | 0.155 | Rigid Ring |
| 2 | C1.1-C2.2-O27.27-C28.2827-26-1-0 C1.28-C2.27-O27.2-C28.1 | 5.299 | Flexible |
| 3 | C1.1-C6.6-C5.5-C4.43-4-5-0 C1.4-C6.5-C5.6-C4.1 | 2.082 | Rigid Ring |
| 4 | C1.1-C6.6-C5.5-C7.76-4-5-0 C1.7-C6.5-C5.6-C7.1 | 178.952 | Rigid Ring |
| 5 | C2.2-C1.1-C6.6-C5.54-5-0-1 C2.5-C1.6-C6.1-C5.2 | -1.41 | Rigid Ring |
| 6 | C2.2-C1.1-O25.25-C26.2625-24-0-1 C2.26-C1.25-O25.1-C26.2 | -178.281 | Flexible |
| 7 | C2.2-C3.3-C4.4-C5.54-3-2-1 C2.5-C3.4-C4.3-C5.2 | 0.45 | Rigid Ring |
| 8 | C2.2-C3.3-C4.4-C9.98-3-2-1 C2.9-C3.4-C4.3-C9.2 | 176.141 | Rigid Ring |
| 9 | C3.3-C2.2-O27.27-C28.2827-26-1-2 C3.28-C2.27-O27.2-C28.3 | 179.311 | Flexible |
| 10 | C3.3-C4.4-C5.5-C6.65-4-3-2 C3.6-C4.5-C5.4-C6.3 | -1.576 | Rigid Ring |
| 11 | C3.3-C4.4-C5.5-C7.76-4-3-2 C3.7-C4.5-C5.4-C7.3 | -178.795 | Rigid Ring |
| 12 | C3.3-C4.4-C9.9-C8.87-8-3-2 C3.8-C4.9-C9.4-C8.3 | -178.571 | Rigid Ring |
| 13 | C4.4-C3.3-C2.2-O27.2726-1-2-3 C4.27-C3.2-C2.3-O27.4 | -174.446 | Rigid |
| 14 | C4.4-C5.5-C7.7-C8.87-6-4-3 C4.8-C5.7-C7.5-C8.4 | -4.449 | Rigid Ring |
| 15 | C4.4-C5.5-C7.7-O24.2423-6-4-3 C4.24-C5.7-C7.5-O24.4 | 173.944 | Rigid |
| 16 | C4.4-C9.9-C8.8-C7.76-7-8-3 C4.7-C9.8-C8.9-C7.4 | -0.05 | Rigid Ring |
| 17 | C4.4-C9.9-C8.8-C10.109-7-8-3 C4.10-C9.8-C8.9-C10.4 | -123.268 | Rigid |
| 18 | C5.5-C4.4-C9.9-C8.87-8-3-4 C5.8-C4.9-C9.4-C8.5 | -2.61 | Rigid Ring |
| 19 | C5.5-C7.7-C8.8-C9.98-7-6-4 C5.9-C7.8-C8.7-C9.5 | 2.592 | Rigid Ring |
| 20 | C5.5-C7.7-C8.8-C10.109-7-6-4 C5.10-C7.8-C8.7-C10.5 | 115.808 | Rigid |
| 21 | C6.6-C1.1-C2.2-C3.32-1-0-5 C6.3-C1.2-C2.1-C3.6 | 0.304 | Rigid Ring |
| 22 | C6.6-C1.1-C2.2-O27.2726-1-0-5 C6.27-C1.2-C2.1-O27.6 | 173.575 | Rigid |
| 23 | C6.6-C1.1-O25.25-C26.2625-24-0-5 C6.26-C1.25-O25.1-C26.6 | 3.303 | Flexible |
| 24 | C6.6-C5.5-C4.4-C9.98-3-4-5 C6.9-C5.4-C4.5-C9.6 | -178.155 | Rigid Ring |
| 25 | C6.6-C5.5-C7.7-C8.87-6-4-5 C6.8-C5.7-C7.5-C8.6 | 178.443 | Rigid Ring |
| 26 | C6.6-C5.5-C7.7-O24.2423-6-4-5 C6.24-C5.7-C7.5-O24.6 | -3.164 | Rigid |
| 27 | C7.7-C5.5-C4.4-C9.98-3-4-6 C7.9-C5.4-C4.5-C9.7 | 4.626 | Rigid Ring |
| 28 | C7.7-C8.8-C10.10-C11.1110-9-7-6 C7.11-C8.10-C10.8-C11.7 | 150.399 | Flexible |
| 29 | C8.8-C10.10-C11.11-C12.1211-10-9-7 C8.12-C10.11-C11.10-C12.8 | -71.388 | Flexible |
| 30 | C8.8-C10.10-C11.11-C16.1615-10-9-7 C8.16-C10.11-C11.10-C16.8 | 56.794 | Flexible |
| 31 | C9.9-C8.8-C7.7-O24.2423-6-7-8 C9.24-C8.7-C7.8-O24.9 | -175.725 | Rigid |
| 32 | C9.9-C8.8-C10.10-C11.1110-9-7-8 C9.11-C8.10-C10.8-C11.9 | -92.933 | Flexible |
| 33 | C10.10-C8.8-C7.7-O24.2423-6-7-9 C10.24-C8.7-C7.8-O24.10 | -62.509 | Rigid |
| 34 | C10.10-C11.11-C12.12-C13.1312-11-10-9 C10.13-C11.12-C12.11-C13.10 | 177.258 | Rigid |
| 35 | C10.10-C11.11-C16.16-C15.1514-15-10-9 C10.15-C11.16-C16.11-C15.10 | -175.053 | Rigid |
| 36 | C11.11-C12.12-C13.13-N14.1413-12-11-10 C11.14-C12.13-C13.12-N14.11 | -54.295 | Rigid Ring |
| 37 | C11.11-C16.16-C15.15-N14.1413-14-15-10 C11.14-C16.15-C15.16-N14.11 | 49.509 | Rigid Ring |
| 38 | C12.12-C11.11-C16.16-C15.1514-15-10-11 C12.15-C11.16-C16.11-C15.12 | -47.156 | Rigid Ring |
| 39 | C12.12-C13.13-N14.14-C15.1514-13-12-11 C12.15-C13.14-N14.13-C15.12 | 59.259 | Rigid Ring |
| 40 | C12.12-C13.13-N14.14-C17.1716-13-12-11 C12.17-C13.14-N14.13-C17.12 | -179.419 | Rigid |
| 41 | C13.13-C12.12-C11.11-C16.1615-10-11-12 C13.16-C12.11-C11.12-C16.13 | 48.178 | Rigid Ring |
| 42 | C13.13-N14.14-C15.15-C16.1615-14-13-12 C13.16-N14.15-C15.14-C16.13 | -55.199 | Rigid Ring |
| 43 | C13.13-N14.14-C17.17-C18.1817-16-13-12 C13.18-N14.17-C17.14-C18.13 | 68.686 | Flexible |
| 44 | N14.14-C17.17-C18.18-C19.1918-17-16-13 N14.19-C17.18-C18.17-C19.14 | 93.899 | Flexible |
| 45 | N14.14-C17.17-C18.18-C23.2322-17-16-13 N14.23-C17.18-C18.17-C23.14 | -83.503 | Flexible |
| 46 | C15.15-N14.14-C17.17-C18.1817-16-13-14 C15.18-N14.17-C17.14-C18.15 | -164.274 | Flexible |
| 47 | C16.16-C15.15-N14.14-C17.1716-13-14-15 C16.17-C15.14-N14.15-C17.16 | 171.958 | Rigid |
| 48 | C17.17-C18.18-C19.19-C20.2019-18-17-16 C17.20-C18.19-C19.18-C20.17 | -173.156 | Rigid |
| 49 | C17.17-C18.18-C23.23-C22.2221-22-17-16 C17.22-C18.23-C23.18-C22.17 | 171.847 | Rigid |
| 50 | C18.18-C19.19-C20.20-C21.2120-19-18-17 C18.21-C19.20-C20.19-C21.18 | -1.261 | Rigid Ring |
| 51 | C18.18-C23.23-C22.22-C21.2120-21-22-17 C18.21-C23.22-C22.23-C21.18 | 3.838 | Rigid Ring |
| 52 | C19.19-C18.18-C23.23-C22.2221-22-17-18 C19.22-C18.23-C23.18-C22.19 | -5.51 | Rigid Ring |
| 53 | C19.19-C20.20-C21.21-C22.2221-20-19-18 C19.22-C20.21-C21.20-C22.19 | -0.46 | Rigid Ring |
| 54 | C20.20-C19.19-C18.18-C23.2322-17-18-19 C20.23-C19.18-C18.19-C23.20 | 4.299 | Rigid Ring |
| 55 | C20.20-C21.21-C22.22-C23.2322-21-20-19 C20.23-C21.22-C22.21-C23.20 | -0.855 | Rigid Ring |
| 56 | O25.25-C1.1-C2.2-C3.32-1-0-24 O25.3-C1.2-C2.1-C3.25 | -178.114 | Rigid |
| 57 | O25.25-C1.1-C2.2-O27.2726-1-0-24 O25.27-C1.2-C2.1-O27.25 | -4.843 | Rigid |
| 58 | O25.25-C1.1-C6.6-C5.54-5-0-24 O25.5-C1.6-C6.1-C5.25 | 177.064 | Rigid |
Dihedrals Histogram