13-cyclohexyl-3-methoxy-17,22-dimethyl-7h-10,6-(methanoiminothioiminobutanoiminomethano)indolo[2,1-a][2]benzazepine-14,23-dione 16,16-dioxide (0LN) Summary
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- 13-cyclohexyl-3-methoxy-17,22-dimethyl-7h-10,6-(methanoiminothioiminobutanoiminomethano)indolo[2,1-a][2]benzazepine-14,23-dione 16,16-dioxide (0LN) Summary
- Dihedrals
Dihedrals Table

Dih. | Atom names | Experimental | Type |
---|---|---|---|
1 | O36.1-C34.2-N35.3-C38.43-2-1-0 O36.4-C34.3-N35.2-C38.1 | -1.839 | Flexible |
2 | O36.1-C34.2-N35.3-C37.54-2-1-0 O36.5-C34.3-N35.2-C37.1 | -179.878 | Flexible |
3 | O36.1-C34.2-C19.18-C20.1918-17-1-0 O36.19-C34.18-C19.2-C20.1 | 130.861 | Flexible |
4 | O36.1-C34.2-C19.18-C18.2322-17-1-0 O36.23-C34.18-C19.2-C18.1 | -51.781 | Flexible |
5 | C34.2-N35.3-C37.5-C39.65-4-2-1 C34.6-N35.5-C37.3-C39.2 | -165.512 | Flexible Ring |
6 | C34.2-C19.18-C20.19-N9.2019-18-17-1 C34.20-C19.19-C20.18-N9.2 | 122.392 | Rigid Ring |
7 | C34.2-C19.18-C18.23-C17.2423-22-17-1 C34.24-C19.23-C18.18-C17.2 | 173.261 | Rigid Ring |
8 | N35.3-C34.2-C19.18-C20.1918-17-1-2 N35.19-C34.18-C19.2-C20.3 | -50.86 | Flexible Ring |
9 | N35.3-C34.2-C19.18-C18.2322-17-1-2 N35.23-C34.18-C19.2-C18.3 | 126.499 | Flexible Ring |
10 | N35.3-C37.5-C39.6-C40.76-5-4-2 N35.7-C37.6-C39.5-C40.3 | -92.19 | Flexible Ring |
11 | C38.4-N35.3-C34.2-C19.1817-1-2-3 C38.18-N35.2-C34.3-C19.4 | 179.902 | Flexible |
12 | C38.4-N35.3-C37.5-C39.65-4-2-3 C38.6-N35.5-C37.3-C39.4 | 16.429 | Flexible |
13 | C37.5-N35.3-C34.2-C19.1817-1-2-4 C37.18-N35.2-C34.3-C19.5 | 1.862 | Flexible Ring |
14 | C37.5-C39.6-C40.7-C41.87-6-5-4 C37.8-C39.7-C40.6-C41.5 | -116.298 | Rigid Ring |
15 | C39.6-C40.7-C41.8-N31.98-7-6-5 C39.9-C40.8-C41.7-N31.6 | 151.315 | Flexible Ring |
16 | C40.7-C41.8-N31.9-C42.109-8-7-6 C40.10-C41.9-N31.8-C42.7 | 121.96 | Flexible |
17 | C40.7-C41.8-N31.9-S30.1110-8-7-6 C40.11-C41.9-N31.8-S30.7 | -112.305 | Flexible Ring |
18 | C41.8-N31.9-S30.11-O32.1211-10-8-7 C41.12-N31.11-S30.9-O32.8 | 145.469 | Flexible |
19 | C41.8-N31.9-S30.11-O33.1312-10-8-7 C41.13-N31.11-S30.9-O33.8 | -93.655 | Flexible |
20 | C41.8-N31.9-S30.11-N29.1413-10-8-7 C41.14-N31.11-S30.9-N29.8 | 28.517 | Flexible Ring |
21 | N31.9-S30.11-N29.14-C27.1514-13-10-8 N31.15-S30.14-N29.11-C27.9 | -102.506 | Flexible Ring |
22 | C42.10-N31.9-S30.11-O32.1211-10-8-9 C42.12-N31.11-S30.9-O32.10 | -86.775 | Rigid |
23 | C42.10-N31.9-S30.11-O33.1312-10-8-9 C42.13-N31.11-S30.9-O33.10 | 34.101 | Rigid |
24 | C42.10-N31.9-S30.11-N29.1413-10-8-9 C42.14-N31.11-S30.9-N29.10 | 156.273 | Rigid |
25 | S30.11-N29.14-C27.15-O28.1615-14-13-10 S30.16-N29.15-C27.14-O28.11 | 1.982 | Rigid |
26 | S30.11-N29.14-C27.15-C1.1716-14-13-10 S30.17-N29.15-C27.14-C1.11 | 176.728 | Rigid Ring |
27 | O32.12-S30.11-N29.14-C27.1514-13-10-11 O32.15-S30.14-N29.11-C27.12 | 139.176 | Flexible |
28 | O33.13-S30.11-N29.14-C27.1514-13-10-12 O33.15-S30.14-N29.11-C27.13 | 19.538 | Flexible |
29 | N29.14-C27.15-C1.17-C6.2221-16-14-13 N29.22-C27.17-C1.15-C6.14 | -10.767 | Flexible Ring |
30 | N29.14-C27.15-C1.17-C2.3635-16-14-13 N29.36-C27.17-C1.15-C2.14 | 173.294 | Flexible Ring |
31 | C27.15-C1.17-C6.22-C5.2120-21-16-14 C27.21-C1.22-C6.17-C5.15 | -177.57 | Rigid Ring |
32 | C27.15-C1.17-C2.36-C3.3534-35-16-14 C27.35-C1.36-C2.17-C3.15 | 177.521 | Rigid Ring |
33 | O28.16-C27.15-C1.17-C6.2221-16-14-15 O28.22-C27.17-C1.15-C6.16 | 164.063 | Flexible |
34 | O28.16-C27.15-C1.17-C2.3635-16-14-15 O28.36-C27.17-C1.15-C2.16 | -11.876 | Flexible |
35 | C1.17-C6.22-C5.21-N9.2019-20-21-16 C1.20-C6.21-C5.22-N9.17 | -178.631 | Rigid Ring |
36 | C1.17-C6.22-C5.21-C4.3433-20-21-16 C1.34-C6.21-C5.22-C4.17 | 0.455 | Rigid Ring |
37 | C1.17-C2.36-C3.35-C4.3433-34-35-16 C1.34-C2.35-C3.36-C4.17 | -0.879 | Rigid Ring |
38 | C19.18-C20.19-N9.20-C5.2120-19-18-17 C19.21-C20.20-N9.19-C5.18 | -115.977 | Rigid Ring |
39 | C19.18-C20.19-N9.20-C8.3231-19-18-17 C19.32-C20.20-N9.19-C8.18 | 62.364 | Rigid Ring |
40 | C19.18-C18.23-C17.24-C24.2524-23-22-17 C19.25-C18.24-C17.23-C24.18 | -134.107 | Rigid Ring |
41 | C19.18-C18.23-C17.24-C16.3130-23-22-17 C19.31-C18.24-C17.23-C16.18 | 36.896 | Rigid Ring |
42 | C20.19-C19.18-C18.23-C17.2423-22-17-18 C20.24-C19.23-C18.18-C17.19 | -9.483 | Rigid Ring |
43 | C20.19-N9.20-C5.21-C6.2221-20-19-18 C20.22-N9.21-C5.20-C6.19 | -2.762 | Rigid Ring |
44 | C20.19-N9.20-C5.21-C4.3433-20-19-18 C20.34-N9.21-C5.20-C4.19 | 178.074 | Rigid Ring |
45 | C20.19-N9.20-C8.32-C16.3130-31-19-18 C20.31-N9.32-C8.20-C16.19 | -0.217 | Rigid Ring |
46 | C20.19-N9.20-C8.32-C7.3332-31-19-18 C20.33-N9.32-C8.20-C7.19 | -177.963 | Rigid Ring |
47 | N9.20-C20.19-C19.18-C18.2322-17-18-19 N9.23-C20.18-C19.19-C18.20 | -54.64 | Rigid Ring |
48 | N9.20-C5.21-C4.34-C7.3332-33-20-19 N9.33-C5.34-C4.21-C7.20 | 0.061 | Rigid Ring |
49 | N9.20-C5.21-C4.34-C3.3534-33-20-19 N9.35-C5.34-C4.21-C3.20 | 179.649 | Rigid Ring |
50 | N9.20-C8.32-C16.31-C17.2423-30-31-19 N9.24-C8.31-C16.32-C17.20 | -46.507 | Rigid Ring |
51 | N9.20-C8.32-C16.31-C21.3029-30-31-19 N9.30-C8.31-C16.32-C21.20 | 135.279 | Rigid Ring |
52 | N9.20-C8.32-C7.33-C4.3433-32-31-19 N9.34-C8.33-C7.32-C4.20 | -0.614 | Rigid Ring |
53 | N9.20-C8.32-C7.33-C10.3736-32-31-19 N9.37-C8.33-C7.32-C10.20 | 178.128 | Rigid |
54 | C5.21-N9.20-C8.32-C16.3130-31-19-20 C5.31-N9.32-C8.20-C16.21 | 178.406 | Rigid Ring |
55 | C5.21-N9.20-C8.32-C7.3332-31-19-20 C5.33-N9.32-C8.20-C7.21 | 0.661 | Rigid Ring |
56 | C5.21-C6.22-C1.17-C2.3635-16-21-20 C5.36-C6.17-C1.22-C2.21 | -1.525 | Rigid Ring |
57 | C5.21-C4.34-C7.33-C8.3231-32-33-20 C5.32-C4.33-C7.34-C8.21 | 0.332 | Rigid Ring |
58 | C5.21-C4.34-C7.33-C10.3736-32-33-20 C5.37-C4.33-C7.34-C10.21 | -178.44 | Rigid |
59 | C5.21-C4.34-C3.35-C2.3635-34-33-20 C5.36-C4.35-C3.34-C2.21 | -0.181 | Rigid Ring |
60 | C6.22-C1.17-C2.36-C3.3534-35-16-21 C6.35-C1.36-C2.17-C3.22 | 1.739 | Rigid Ring |
61 | C6.22-C5.21-N9.20-C8.3231-19-20-21 C6.32-C5.20-N9.21-C8.22 | 178.707 | Rigid Ring |
62 | C6.22-C5.21-C4.34-C7.3332-33-20-21 C6.33-C5.34-C4.21-C7.22 | -179.189 | Rigid Ring |
63 | C6.22-C5.21-C4.34-C3.3534-33-20-21 C6.35-C5.34-C4.21-C3.22 | 0.399 | Rigid Ring |
64 | C18.23-C17.24-C24.25-C23.2625-24-23-22 C18.26-C17.25-C24.24-C23.23 | 173.684 | Rigid Ring |
65 | C18.23-C17.24-C16.31-C21.3029-30-23-22 C18.30-C17.31-C16.24-C21.23 | -172.305 | Rigid Ring |
66 | C18.23-C17.24-C16.31-C8.3231-30-23-22 C18.32-C17.31-C16.24-C8.23 | 9.478 | Rigid Ring |
67 | C17.24-C24.25-C23.26-O25.2726-25-24-23 C17.27-C24.26-C23.25-O25.24 | 178.556 | Rigid |
68 | C17.24-C24.25-C23.26-C22.2928-25-24-23 C17.29-C24.26-C23.25-C22.24 | -1.209 | Rigid Ring |
69 | C17.24-C16.31-C21.30-C22.2928-29-30-23 C17.29-C16.30-C21.31-C22.24 | 0.215 | Rigid Ring |
70 | C17.24-C16.31-C8.32-C7.3332-31-30-23 C17.33-C16.32-C8.31-C7.24 | 130.796 | Rigid Ring |
71 | C24.25-C17.24-C16.31-C21.3029-30-23-24 C24.30-C17.31-C16.24-C21.25 | -1.689 | Rigid Ring |
72 | C24.25-C17.24-C16.31-C8.3231-30-23-24 C24.32-C17.31-C16.24-C8.25 | -179.906 | Rigid Ring |
73 | C24.25-C23.26-O25.27-C26.2827-26-25-24 C24.28-C23.27-O25.26-C26.25 | 104.17 | Flexible |
74 | C24.25-C23.26-C22.29-C21.3029-28-25-24 C24.30-C23.29-C22.26-C21.25 | -0.285 | Rigid Ring |
75 | C23.26-C24.25-C17.24-C16.3130-23-24-25 C23.31-C24.24-C17.25-C16.26 | 2.207 | Rigid Ring |
76 | C23.26-C22.29-C21.30-C16.3130-29-28-25 C23.31-C22.30-C21.29-C16.26 | 0.776 | Rigid Ring |
77 | O25.27-C23.26-C22.29-C21.3029-28-25-26 O25.30-C23.29-C22.26-C21.27 | 179.948 | Rigid |
78 | C26.28-O25.27-C23.26-C22.2928-25-26-27 C26.29-O25.26-C23.27-C22.28 | -76.066 | Flexible |
79 | C22.29-C21.30-C16.31-C8.3231-30-29-28 C22.32-C21.31-C16.30-C8.29 | 178.493 | Rigid Ring |
80 | C21.30-C16.31-C8.32-C7.3332-31-30-29 C21.33-C16.32-C8.31-C7.30 | -47.418 | Rigid Ring |
81 | C16.31-C8.32-C7.33-C4.3433-32-31-30 C16.34-C8.33-C7.32-C4.31 | -178.265 | Rigid Ring |
82 | C16.31-C8.32-C7.33-C10.3736-32-31-30 C16.37-C8.33-C7.32-C10.31 | 0.476 | Rigid |
83 | C8.32-N9.20-C5.21-C4.3433-20-19-31 C8.34-N9.21-C5.20-C4.32 | -0.457 | Rigid Ring |
84 | C8.32-C7.33-C4.34-C3.3534-33-32-31 C8.35-C7.34-C4.33-C3.32 | -179.196 | Rigid Ring |
85 | C8.32-C7.33-C10.37-C15.3837-36-32-31 C8.38-C7.37-C10.33-C15.32 | 127.416 | Rigid |
86 | C8.32-C7.33-C10.37-C11.4241-36-32-31 C8.42-C7.37-C10.33-C11.32 | -109.52 | Rigid |
87 | C7.33-C4.34-C3.35-C2.3635-34-33-32 C7.36-C4.35-C3.34-C2.33 | 179.289 | Rigid Ring |
88 | C7.33-C10.37-C15.38-C14.3938-37-36-32 C7.39-C10.38-C15.37-C14.33 | -179.177 | Rigid |
89 | C7.33-C10.37-C11.42-C12.4140-41-36-32 C7.41-C10.42-C11.37-C12.33 | 174.897 | Rigid |
90 | C4.34-C7.33-C10.37-C15.3837-36-32-33 C4.38-C7.37-C10.33-C15.34 | -54.075 | Rigid |
91 | C4.34-C7.33-C10.37-C11.4241-36-32-33 C4.42-C7.37-C10.33-C11.34 | 68.989 | Rigid |
92 | C3.35-C4.34-C7.33-C10.3736-32-33-34 C3.37-C4.33-C7.34-C10.35 | 2.033 | Rigid |
93 | C10.37-C15.38-C14.39-C13.4039-38-37-36 C10.40-C15.39-C14.38-C13.37 | -60.86 | Rigid Ring |
94 | C10.37-C11.42-C12.41-C13.4039-40-41-36 C10.40-C11.41-C12.42-C13.37 | 59.415 | Rigid Ring |
95 | C15.38-C10.37-C11.42-C12.4140-41-36-37 C15.41-C10.42-C11.37-C12.38 | -59.572 | Rigid Ring |
96 | C15.38-C14.39-C13.40-C12.4140-39-38-37 C15.41-C14.40-C13.39-C12.38 | 62.307 | Rigid Ring |
97 | C14.39-C15.38-C10.37-C11.4241-36-37-38 C14.42-C15.37-C10.38-C11.39 | 59.35 | Rigid Ring |
98 | C14.39-C13.40-C12.41-C11.4241-40-39-38 C14.42-C13.41-C12.40-C11.39 | -60.821 | Rigid Ring |
Dihedrals Histogram


