(1s,2s,5s)2-(4-glutaridylbenzyl)-5-phenyl-1-cyclohexanol (HOP) Summary
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- (1s,2s,5s)2-(4-glutaridylbenzyl)-5-phenyl-1-cyclohexanol (HOP) Summary
- Dihedrals
Dihedrals Table
| Dih. | Atom names | Experimental | Type |
|---|---|---|---|
| 1 | C1.1-C2.2-C3.6-C4.54-5-1-0 C1.5-C2.6-C3.2-C4.1 | -0.369 | Rigid Ring |
| 2 | C1.1-C6.3-C5.4-C4.54-3-2-0 C1.5-C6.4-C5.3-C4.1 | 0.046 | Rigid Ring |
| 3 | C2.2-C1.1-C6.3-C5.43-2-0-1 C2.4-C1.3-C6.1-C5.2 | -0.007 | Rigid Ring |
| 4 | C2.2-C3.6-C4.5-C5.43-4-5-1 C2.4-C3.5-C4.6-C5.2 | 0.404 | Rigid Ring |
| 5 | C2.2-C3.6-C4.5-C7.76-4-5-1 C2.7-C3.5-C4.6-C7.2 | 179.17 | Rigid |
| 6 | C6.3-C1.1-C2.2-C3.65-1-0-2 C6.6-C1.2-C2.1-C3.3 | 0.167 | Rigid Ring |
| 7 | C6.3-C5.4-C4.5-C3.65-4-3-2 C6.6-C5.5-C4.4-C3.3 | -0.242 | Rigid Ring |
| 8 | C6.3-C5.4-C4.5-C7.76-4-3-2 C6.7-C5.5-C4.4-C7.3 | -178.993 | Rigid |
| 9 | C5.4-C4.5-C7.7-C12.87-6-4-3 C5.8-C4.7-C7.5-C12.4 | 33.53 | Flexible |
| 10 | C5.4-C4.5-C7.7-C8.1211-6-4-3 C5.12-C4.7-C7.5-C8.4 | -91.251 | Flexible |
| 11 | C4.5-C7.7-C12.8-C11.98-7-6-4 C4.9-C7.8-C12.7-C11.5 | -179.831 | Rigid |
| 12 | C4.5-C7.7-C8.12-C9.1110-11-6-4 C4.11-C7.12-C8.7-C9.5 | 179.499 | Rigid |
| 13 | C3.6-C4.5-C7.7-C12.87-6-4-5 C3.8-C4.7-C7.5-C12.6 | -145.207 | Flexible |
| 14 | C3.6-C4.5-C7.7-C8.1211-6-4-5 C3.12-C4.7-C7.5-C8.6 | 90.012 | Flexible |
| 15 | C7.7-C12.8-C11.9-C10.109-8-7-6 C7.10-C12.9-C11.8-C10.7 | 57.246 | Rigid Ring |
| 16 | C7.7-C12.8-C11.9-O19.1918-8-7-6 C7.19-C12.9-C11.8-O19.7 | -179.625 | Rigid |
| 17 | C7.7-C8.12-C9.11-C10.109-10-11-6 C7.10-C8.11-C9.12-C10.7 | -56.017 | Rigid Ring |
| 18 | C12.8-C7.7-C8.12-C9.1110-11-6-7 C12.11-C7.12-C8.7-C9.8 | 52.956 | Rigid Ring |
| 19 | C12.8-C11.9-C10.10-C9.1110-9-8-7 C12.11-C11.10-C10.9-C9.8 | -57.182 | Rigid Ring |
| 20 | C12.8-C11.9-C10.10-C13.1312-9-8-7 C12.13-C11.10-C10.9-C13.8 | 179.712 | Rigid |
| 21 | C11.9-C12.8-C7.7-C8.1211-6-7-8 C11.12-C12.7-C7.8-C8.9 | -54.524 | Rigid Ring |
| 22 | C11.9-C10.10-C9.11-C8.1211-10-9-8 C11.12-C10.11-C9.10-C8.9 | 57.741 | Rigid Ring |
| 23 | C11.9-C10.10-C13.13-C14.1413-12-9-8 C11.14-C10.13-C13.10-C14.9 | -86.401 | Flexible |
| 24 | C11.9-C10.10-C13.13-C18.1817-12-9-8 C11.18-C10.13-C13.10-C18.9 | 93.438 | Flexible |
| 25 | C10.10-C13.13-C14.14-C15.1514-13-12-9 C10.15-C13.14-C14.13-C15.10 | -179.609 | Rigid |
| 26 | C10.10-C13.13-C18.18-C17.1716-17-12-9 C10.17-C13.18-C18.13-C17.10 | 179.547 | Rigid |
| 27 | C9.11-C10.10-C11.9-O19.1918-8-9-10 C9.19-C10.9-C11.10-O19.11 | -178.774 | Rigid |
| 28 | C9.11-C10.10-C13.13-C14.1413-12-9-10 C9.14-C10.13-C13.10-C14.11 | 151.64 | Flexible |
| 29 | C9.11-C10.10-C13.13-C18.1817-12-9-10 C9.18-C10.13-C13.10-C18.11 | -28.521 | Flexible |
| 30 | C8.12-C9.11-C10.10-C13.1312-9-10-11 C8.13-C9.10-C10.11-C13.12 | -179.583 | Rigid |
| 31 | C13.13-C10.10-C11.9-O19.1918-8-9-12 C13.19-C10.9-C11.10-O19.13 | 58.12 | Rigid |
| 32 | C13.13-C14.14-C15.15-C16.1615-14-13-12 C13.16-C14.15-C15.14-C16.13 | 0.194 | Rigid Ring |
| 33 | C13.13-C18.18-C17.17-C16.1615-16-17-12 C13.16-C18.17-C17.18-C16.13 | -0.052 | Rigid Ring |
| 34 | C14.14-C13.13-C18.18-C17.1716-17-12-13 C14.17-C13.18-C18.13-C17.14 | -0.615 | Rigid Ring |
| 35 | C14.14-C15.15-C16.16-C17.1716-15-14-13 C14.17-C15.16-C16.15-C17.14 | -0.848 | Rigid Ring |
| 36 | C14.14-C15.15-C16.16-C20.2019-15-14-13 C14.20-C15.16-C16.15-C20.14 | -179.2 | Rigid |
| 37 | C15.15-C14.14-C13.13-C18.1817-12-13-14 C15.18-C14.13-C13.14-C18.15 | 0.548 | Rigid Ring |
| 38 | C15.15-C16.16-C17.17-C18.1817-16-15-14 C15.18-C16.17-C17.16-C18.15 | 0.782 | Rigid Ring |
| 39 | C15.15-C16.16-C20.20-O21.2120-19-15-14 C15.21-C16.20-C20.16-O21.15 | -166.559 | Flexible |
| 40 | C15.15-C16.16-C20.20-N22.2221-19-15-14 C15.22-C16.20-C20.16-N22.15 | 12.967 | Flexible |
| 41 | C16.16-C20.20-N22.22-C23.2322-21-19-15 C16.23-C20.22-N22.20-C23.16 | -178.236 | Rigid |
| 42 | C17.17-C16.16-C20.20-O21.2120-19-15-16 C17.21-C16.20-C20.16-O21.17 | 15.144 | Flexible |
| 43 | C17.17-C16.16-C20.20-N22.2221-19-15-16 C17.22-C16.20-C20.16-N22.17 | -165.33 | Flexible |
| 44 | C18.18-C17.17-C16.16-C20.2019-15-16-17 C18.20-C17.16-C16.17-C20.18 | 179.102 | Rigid |
| 45 | C20.20-N22.22-C23.23-C24.2423-22-21-19 C20.24-N22.23-C23.22-C24.20 | 169.111 | Flexible |
| 46 | O21.21-C20.20-N22.22-C23.2322-21-19-20 O21.23-C20.22-N22.20-C23.21 | 1.275 | Rigid |
| 47 | N22.22-C23.23-C24.24-C25.2524-23-22-21 N22.25-C23.24-C24.23-C25.22 | -10.154 | Flexible |
| 48 | C23.23-C24.24-C25.25-C26.2625-24-23-22 C23.26-C24.25-C25.24-C26.23 | -174.471 | Flexible |
| 49 | C24.24-C25.25-C26.26-O27.2726-25-24-23 C24.27-C25.26-C26.25-O27.24 | -64.587 | Flexible |
| 50 | C24.24-C25.25-C26.26-O28.2827-25-24-23 C24.28-C25.26-C26.25-O28.24 | 116.263 | Flexible |
Dihedrals Histogram