Table 10.
Torsional angles [°] for compound 2.
| Torsional angles [°] | |||||
|---|---|---|---|---|---|
| C30-O1-C27-C26 | -0.0(3) | C3-C4-C10-N1 | 44.0(3) | N1-C18-C23-H23 | -0.7 |
| C30-O1-C27-C28 | 178.3(2) | C3-C4-C10-H10 | 159 | C19-C18-C23-C22 | -1.3(3) |
| C27-O1-C30-H30A | 62.6 | C3-C4-C10-C11 | -83.7(2) | C19-C18-C23-H23 | 178.7 |
| C27-O1-C30-H30B | -57.4 | C5-C4-C10-N1 | -136.2(2) | C18-C19-C20-H20 | 179.3 |
| C27-O1-C30-H30C | -177.4 | C5-C4-C10-H10 | -21.3 | C18-C19-C20-C21 | -0.8(3) |
| C17-O2-C14-C13 | -158.8(2) | C5-C4-C10-C11 | 96.0(2) | H19-C19-C20-H20 | -0.6 |
| C17-O2-C14-C15 | 22.2(3) | O3-C6-C7-H7 | 62.2 | H19-C19-C20-C21 | 179.3 |
| C14-O2-C17-H17A | 171.2 | O3-C6-C7-C8 | 179.1(2) | C19-C20-C21-F1 | 179.9(2) |
| C14-O2-C17-H17B | 51.3 | O3-C6-C7-C9 | -57.2(3) | C19-C20-C21-C22 | -0.0(3) |
| C14-O2-C17-H17C | -68.8 | H6A-C6-C7-H7 | -177.3 | H20-C20-C21-F1 | -0.1 |
| C6-O3-C5-O4 | 2.8(3) | H6A-C6-C7-C8 | -60.3 | H20-C20-C21-C22 | 179.9 |
| C6-O3-C5-C4 | -176.2(2) | H6A-C6-C7-C9 | 63.3 | F1-C21-C22-H22 | 0.1 |
| C5-O3-C6-H6A | 64.1 | H6AB-C6-C7-H7 | -58.3 | F1-C21-C22-C23 | -179.8(2) |
| C5-O3-C6-H6AB | -54.9 | H6AB-C6-C7-C8 | 58.6 | C20-C21-C22-H22 | -180 |
| C5-O3-C6-C7 | -175.4(2) | H6AB-C6-C7-C9 | -177.7 | C20-C21-C22-C23 | 0.1(4) |
| C10-N1-C1-H1 | -128.2 | C6-C7-C8-H8A | -56 | C21-C22-C23-C18 | 0.6(3) |
| C10-N1-C1-C2 | -10.7(3) | C6-C7-C8-H8B | -176 | C21-C22-C23-H23 | -179.4 |
| C10-N1-C1-C24 | 111.4(2) | C6-C7-C8-H8C | 64 | H22-C22-C23-C18 | -179.3 |
| C18-N1-C1-H1 | 45.2 | H7-C7-C8-H8A | 61 | H22-C22-C23-H23 | 0.7 |
| C18-N1-C1-C2 | 162.7(2) | H7-C7-C8-H8B | -59.1 | C1-C24-C25-H25 | -3.5 |
| C18-N1-C1-C24 | -75.2(2) | H7-C7-C8-H8C | -179 | C1-C24-C25-C26 | 176.5(2) |
| C1-N1-C10-C4 | -37.8(3) | C9-C7-C8-H8A | 179.4 | C29-C24-C25-H25 | 179.5 |
| C1-N1-C10-H10 | -152.8 | C9-C7-C8-H8B | 59.4 | C29-C24-C25-C26 | -0.5(3) |
| C1-N1-C10-C11 | 90.3(2) | C9-C7-C8-H8C | -60.5 | C1-C24-C29-C28 | -177.1(2) |
| C18-N1-C10-C4 | 148.8(2) | C6-C7-C9-H9A | -58.3 | C1-C24-C29-H29 | 2.9 |
| C18-N1-C10-H10 | 33.8 | C6-C7-C9-H9B | -178.3 | C25-C24-C29-C28 | -0.2(3) |
| C18-N1-C10-C11 | -83.1(2) | C6-C7-C9-H9C | 61.8 | C25-C24-C29-H29 | 179.8 |
| C1-N1-C18-C19 | -166.2(2) | H7-C7-C9-H9A | -177.7 | C24-C25-C26-H26 | -179.3 |
| C1-N1-C18-C23 | 13.2(3) | H7-C7-C9-H9B | 62.3 | C24-C25-C26-C27 | 0.7(3) |
| C10-N1-C18-C19 | 7.1(3) | H7-C7-C9-H9C | -57.6 | H25-C25-C26-H26 | 0.7 |
| C10-N1-C18-C23 | -173.5(2) | C8-C7-C9-H9A | 63.8 | H25-C25-C26-C27 | -179.3 |
| H2-N2-C3-C2 | -174(2) | C8-C7-C9-H9B | -56.2 | C25-C26-C27-O1 | 177.9(2) |
| H2-N2-C3-C4 | 1(2) | C8-C7-C9-H9C | -176.1 | C25-C26-C27-C28 | -0.3(3) |
| C31-N2-C3-C2 | 19.7(3) | N1-C10-C11-C12 | -174.3(2) | H26-C26-C27-O1 | -2.1 |
| C31-N2-C3-C4 | -165.4(2) | N1-C10-C11-C16 | 8.8(3) | H26-C26-C27-C28 | 179.7 |
| H2-N2-C31-C32 | 65(2) | C4-C10-C11-C12 | -48.5(3) | O1-C27-C28-H28 | 1.2 |
| H2-N2-C31-C36 | -112(2) | C4-C10-C11-C16 | 134.6(2) | O1-C27-C28-C29 | -178.8(2) |
| C3-N2-C31-C32 | -129.4(2) | H10-C10-C11-C12 | 68.8 | C26-C27-C28-H28 | 179.5 |
| C3-N2-C31-C36 | 54.2(3) | H10-C10-C11-C16 | -108.1 | C26-C27-C28-C29 | -0.4(3) |
| N1-C1-C2-H2A | 175.9 | C10-C11-C12-H12 | 3.7 | C27-C28-C29-C24 | 0.7(3) |
| N1-C1-C2-H2AB | -64.7 | C10-C11-C12-C13 | -176.3(2) | C27-C28-C29-H29 | -179.3 |
| N1-C1-C2-C3 | 55.6(2) | C16-C11-C12-H12 | -179.2 | H28-C28-C29-C24 | -179.3 |
| H1-C1-C2-H2A | -66.6 | C16-C11-C12-C13 | 0.8(3) | H28-C28-C29-H29 | 0.7 |
| H1-C1-C2-H2AB | 52.8 | C10-C11-C16-C15 | 176.8(2) | N2-C31-C32-H32 | 4.2 |
| H1-C1-C2-C3 | 173.1 | C10-C11-C16-H16 | -3.2 | N2-C31-C32-C33 | -175.8(2) |
| C24-C1-C2-H2A | 50.4 | C12-C11-C16-C15 | -0.2(3) | C36-C31-C32-H32 | -179.3 |
| C24-C1-C2-H2AB | 169.8 | C12-C11-C16-H16 | 179.8 | C36-C31-C32-C33 | 0.7(3) |
| C24-C1-C2-C3 | -69.9(2) | C11-C12-C13-H13 | 179.1 | N2-C31-C36-C35 | 176.8(2) |
| N1-C1-C24-C25 | 161.1(2) | C11-C12-C13-C14 | -0.9(3) | N2-C31-C36-H36 | -3.2 |
| N1-C1-C24-C29 | -22.1(3) | H12-C12-C13-H13 | -0.9 | C32-C31-C36-C35 | 0.4(3) |
| H1-C1-C24-C25 | 40.6 | H12-C12-C13-C14 | 179.1 | C32-C31-C36-H36 | -179.6 |
| H1-C1-C24-C29 | -142.6 | C12-C13-C14-O2 | -178.8(2) | C31-C32-C33-H33 | 179.4 |
| C2-C1-C24-C25 | -76.4(2) | C12-C13-C14-C15 | 0.3(3) | C31-C32-C33-C34 | -0.6(3) |
| C2-C1-C24-C29 | 100.4(2) | H13-C13-C14-O2 | 1.2 | H32-C32-C33-H33 | -0.6 |
| C1-C2-C3-N2 | 123.2(2) | H13-C13-C14-C15 | -179.7 | H32-C32-C33-C34 | 179.4 |
| C1-C2-C3-C4 | -52.1(2) | O2-C14-C15-H15 | -0.8 | C32-C33-C34-F2 | 179.8(2) |
| H2A-C2-C3-N2 | 3 | O2-C14-C15-C16 | 179.2(2) | C32-C33-C34-C35 | -0.5(4) |
| H2A-C2-C3-C4 | -172.4 | C13-C14-C15-H15 | -179.8 | H33-C33-C34-F2 | -0.3 |
| H2AB-C2-C3-N2 | -116.5 | C13-C14-C15-C16 | 0.2(3) | H33-C33-C34-C35 | 179.4 |
| H2AB-C2-C3-C4 | 68.2 | C14-C15-C16-C11 | -0.3(3) | F2-C34-C35-H35 | 1.3 |
| N2-C3-C4-C5 | 6.4(3) | C14-C15-C16-H16 | 179.7 | F2-C34-C35-C36 | -178.7(2) |
| N2-C3-C4-C10 | -173.8(2) | H15-C15-C16-C11 | 179.7 | C33-C34-C35-H35 | -178.5 |
| C2-C3-C4-C5 | -178.5(2) | H15-C15-C16-H16 | -0.3 | C33-C34-C35-C36 | 1.6(4) |
| C2-C3-C4-C10 | 1.3(3) | N1-C18-C19-H19 | 0.7 | C34-C35-C36-C31 | -1.4(3) |
| C3-C4-C5-O3 | 169.2(2) | N1-C18-C19-C20 | -179.1(2) | C34-C35-C36-H36 | 178.6 |
| C3-C4-C5-O4 | -9.8(4) | C23-C18-C19-H19 | -178.7 | H35-C35-C36-C31 | 178.6 |
| C10-C4-C5-O3 | -10.6(3) | C23-C18-C19-C20 | 1.4(3) | H35-C35-C36-H36 | -1.4 |
| C10-C4-C5-O4 | 170.5(2) | N1-C18-C23-C22 | 179.3(2) | ||