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3-pyridin-4-yl-2,4-dihydro-indeno[1,2-.c.]pyrazole Summary
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3-pyridin-4-yl-2,4-dihydro-indeno[1,2-.c.]pyrazole Summary
Dihedrals
Molecule
Trajectories
PCA
Clusters
Dihedrals
QM
Dihedrals Table
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Flexible
Restrained
Rigid
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Dihedral
Atom names
Experimental
Type
1
CL-C-C1-N
N-C1-C-CL
-
Rigid
2
CL-C-C1-C11
C11-C1-C-CL
-
Rigid
3
CL-C-C14-C13
C13-C14-C-CL
-
Rigid
4
C-C1-N-C2
C2-N-C1-C
-
Flexible
5
C-C1-C11-F
F-C11-C1-C
-
Rigid
6
C-C1-C11-C12
C12-C11-C1-C
-
Rigid
7
C-C14-C13-C12
C12-C13-C14-C
-
Rigid
8
C1-C-C14-C13
C13-C14-C-C1
-
Rigid
9
C1-N-C2-C3
C3-C2-N-C1
-
Flexible
10
C1-N-C2-C7
C7-C2-N-C1
-
Flexible
11
C1-C11-C12-C13
C13-C12-C11-C1
-
Rigid
12
N-C1-C-C14
C14-C-C1-N
-
Rigid
13
N-C1-C11-F
F-C11-C1-N
-
Rigid
14
N-C1-C11-C12
C12-C11-C1-N
-
Rigid
15
N-C2-C3-C4
C4-C3-C2-N
-
Rigid
16
N-C2-C3-C9
C9-C3-C2-N
-
Rigid
17
N-C2-C7-C6
C6-C7-C2-N
-
Rigid
18
C2-N-C1-C11
C11-C1-N-C2
-
Flexible
19
C2-C3-C4-C5
C5-C4-C3-C2
-
Rigid
20
C2-C3-C9-C10
C10-C9-C3-C2
-
Restrained
21
C2-C7-C6-C5
C5-C6-C7-C2
-
Rigid
22
C3-C2-C7-C6
C6-C7-C2-C3
-
Rigid
23
C3-C4-C5-C6
C6-C5-C4-C3
-
Rigid
24
C3-C4-C5-C8
C8-C5-C4-C3
-
Rigid
25
C3-C9-C10-O
O-C10-C9-C3
-
Flexible
26
C3-C9-C10-O1
O1-C10-C9-C3
-
Flexible
27
C4-C3-C2-C7
C7-C2-C3-C4
-
Rigid
28
C4-C3-C9-C10
C10-C9-C3-C4
-
Flexible
29
C4-C5-C6-C7
C7-C6-C5-C4
-
Rigid
30
C5-C4-C3-C9
C9-C3-C4-C5
-
Rigid
31
C7-C2-C3-C9
C9-C3-C2-C7
-
Rigid
32
C7-C6-C5-C8
C8-C5-C6-C7
-
Rigid
33
C11-C1-C-C14
C14-C-C1-C11
-
Rigid
34
C11-C12-C13-C14
C14-C13-C12-C11
-
Rigid
35
F-C11-C12-C13
C13-C12-C11-F
-
Rigid
Dihedrals
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