Chemical Components in the PDB

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PDBeChem : Chemical Bonds

 Molecule : DI4    

Bonds between two atoms of the molecule

Total Number of Bonds: 68


Record First Atom Second Atom First Element Second Element Bond Order Type Bond Length Bond Stereochemistry Is Aromatic
1 B1 C B C sing 1.57 N N
2 B1 O B O sing 1.42 N N
3 B1 O1 B O sing 1.42 N N
4 C C2 C C sing 1.53 N N
5 C N C N sing 1.46 N N
6 C H C H sing 1.09 N N
7 C2 C3 C C sing 1.53 N N
8 C2 H21 C H sing 1.09 N N
9 C2 H22A C H sing 1.09 N N
10 C3 C4 C C sing 1.53 N N
11 C3 H31 C H sing 1.09 N N
12 C3 H32 C H sing 1.09 N N
13 C4 C5 C C sing 1.53 N N
14 C4 H41 C H sing 1.09 N N
15 C4 H42 C H sing 1.09 N N
16 C5 C6 C C sing 1.53 N N
17 C5 H51 C H sing 1.09 N N
18 C5 H52 C H sing 1.09 N N
19 C6 N1 C N sing 1.47 N N
20 C6 H61 C H sing 1.09 N N
21 C6 H62 C H sing 1.09 N N
22 C7 C8 C C sing 1.51 N N
23 C7 C9 C C sing 1.54 N N
24 C7 N2 C N sing 1.47 N N
25 C7 H7 C H sing 1.09 N N
26 C8 N C N sing 1.35 N N
27 C8 O2 C O doub 1.21 N N
28 C9 C10 C C sing 1.55 N N
29 C9 H91 C H sing 1.09 N N
30 C9 H92 C H sing 1.09 N N
31 C10 C11 C C sing 1.55 N N
32 C10 H101 C H sing 1.09 N N
33 C10 H102 C H sing 1.09 N N
34 C11 N2 C N sing 1.47 N N
35 C11 H111 C H sing 1.09 N N
36 C11 H112 C H sing 1.09 N N
37 C12 C14 C C sing 1.51 N N
38 C12 N2 C N sing 1.35 N N
39 C12 O3 C O doub 1.21 N N
40 C13 C14 C C sing 1.53 N N
41 C13 C21 C C sing 1.51 N N
42 C13 H131 C H sing 1.09 N N
43 C13 H132 C H sing 1.09 N N
44 C14 N3 C N sing 1.46 N N
45 C14 H14 C H sing 1.09 N N
46 C15 C16 C C sing 1.51 N N
47 C15 N3 C N sing 1.35 N N
48 C15 O4 C O doub 1.21 N N
49 C16 H161 C H sing 1.09 N N
50 C16 H162 C H sing 1.09 N N
51 C16 H163 C H sing 1.09 N N
52 C17 C18 C C doub 1.38 N Y
53 C17 C22 C C sing 1.38 N Y
54 C17 H17 C H sing 1.08 N N
55 C18 C19 C C sing 1.38 N Y
56 C18 H18 C H sing 1.08 N N
57 C19 C20 C C doub 1.38 N Y
58 C19 H19 C H sing 1.08 N N
59 C20 C21 C C sing 1.38 N Y
60 C20 H20 C H sing 1.08 N N
61 C21 C22 C C doub 1.38 N Y
62 C22 H22 C H sing 1.08 N N
63 N HN N H sing 0.97 N N
64 N1 HN11 N H sing 1.01 N N
65 N1 HN12 N H sing 1.01 N N
66 N3 HN3 N H sing 0.97 N N
67 O HO O H sing 0.97 N N
68 O1 HO1 O H sing 0.97 N N