|
imidazol-1-yl
General|
C,H only|
N-H|
O-H|
Other N or O|
Sulfur|
Halo/halide|
Alkali Metal|
Amino acid
|
General
|
 Links to statistical data |
 Links to theoretical energy data |
| Contact Group |
CSD |
PDB |
Stats |
Theory |
| any C,N,O,S or H |
9924 |
1657 |
|
|
| any polar X-H (X= N,O or S) |
2661 |
599 |
|
|
* This search has not been done.
General|
C,H only|
N-H|
O-H|
Other N or O|
Sulfur|
Halo/halide|
Alkali Metal|
Amino acid
|
C,H only
|
|
Links to statistical data |
Links to theoretical energy data |
| Contact Group |
CSD |
PDB |
Stats |
Theory |
| any alkyl C-H |
4957 |
494 |
|
|
| methylene |
706 |
92 |
|
|
| methyl |
1736 |
243 |
|
|
| any aromatic C-H |
4979 |
217 |
|
|
| substituted aromatic carbon |
1065 |
30 |
|
|
| phenyl |
1427 |
72 |
|
|
* This search has not been done.
General|
C,H only|
N-H|
O-H|
Other N or O|
Sulfur|
Halo/halide|
Alkali Metal|
Amino acid
|
N-H
|
|
Links to statistical data |
Links to theoretical energy data |
| Contact Group |
CSD |
PDB |
Stats |
Theory |
| any NH |
659 |
167 |
|
|
| any uncharged NH |
380 |
* |
|
|
| any cationic NH |
81 |
* |
|
|
| aromatic cationic N-H |
60 |
* |
|
|
| amide NH |
103 |
36 |
|
|
| uncharged C(sp2)/C(ar)-NH2 |
63 |
* |
|
|
| cationic RNH3 |
8 |
12 |
|
|
| cationic R3NH |
|
* |
|
|
* This search has not been done.
General|
C,H only|
N-H|
O-H|
Other N or O|
Sulfur|
Halo/halide|
Alkali Metal|
Amino acid
|
O-H
|
|
Links to statistical data |
Links to theoretical energy data |
| Contact Group |
CSD |
PDB |
Stats |
Theory |
| any OH |
2002 |
405 |
|
|
| alcohol OH |
297 |
56 |
|
|
| phenol OH |
228 |
30 |
|
|
| water |
657 |
319 |
|
|
* This search has not been done.
General|
C,H only|
N-H|
O-H|
Other N or O|
Sulfur|
Halo/halide|
Alkali Metal|
Amino acid
|
Other N or O
|
|
Links to statistical data |
Links to theoretical energy data |
| Contact Group |
CSD |
PDB |
Stats |
Theory |
| aromatic or sp2 N |
2165 |
15 |
|
|
| cyano |
150 |
|
|
|
| pyramidal R3N |
11 |
* |
|
|
| uncharged planar R3N |
1063 |
|
|
|
| cationic planar R3N |
6 |
|
|
|
|
| any terminal O |
1983 |
292 |
|
|
| any C=O |
1148 |
292 |
|
|
| amide C=O |
135 |
119 |
|
|
| ester C=O |
171 |
|
|
|
| carboxylate |
47 |
136 |
|
|
| aliphatic ether |
24 |
|
|
|
| linking O in esters |
68 |
|
|
|
| aromatic O |
14 |
|
|
|
| sulfoxide/sulfone O |
28 |
|
|
|
| nitro |
623 |
* |
|
|
* This search has not been done.
General|
C,H only|
N-H|
O-H|
Other N or O|
Sulfur|
Halo/halide|
Alkali Metal|
Amino acid
|
Sulfur
|
|
Links to statistical data |
Links to theoretical energy data |
| Contact Group |
CSD |
PDB |
Stats |
Theory |
| any S |
280 |
34 |
|
|
| any C=S |
38 |
|
|
|
| aliphatic thioether |
9 |
7 |
|
|
| aromatic S |
57 |
|
|
|
* This search has not been done.
General|
C,H only|
N-H|
O-H|
Other N or O|
Sulfur|
Halo/halide|
Alkali Metal|
Amino acid
|
Halo/Halide
|
|
Links to statistical data |
Links to theoretical energy data |
| Contact Group |
CSD |
PDB |
Stats |
Theory |
| any C-F |
364 |
|
|
|
| any C-Cl |
323 |
|
|
|
| any C-Br |
132 |
|
|
|
| any C-I |
206 |
|
|
|
| chloride ion |
39 |
|
|
|
| bromide ion |
10 |
|
|
|
| iodide ion |
16 |
|
|
|
* This search has not been done.
General|
C,H only|
N-H|
O-H|
Other N or O|
Sulfur|
Halo/Halide|
Alkali Metal|
Amino acid
|
Alkali Metal
|
|
Links to statistical data |
Links to theoretical energy data |
| Contact Group |
CSD |
PDB |
Stats |
Theory |
| lithium ion |
|
|
|
|
| sodium ion |
|
|
|
|
| potassium ion |
12 |
|
|
|
| rubidium ion |
|
|
|
|
| cesuim ion |
|
|
|
|
* This search has not been done.
General|
C,H only|
N-H|
O-H|
Other N or O|
Sulfur|
Halo/halide|
Alkali Metal|
Amino acid
|
Amino acid
|
|
Links to statistical data |
Links to theoretical energy data |
| Contact Group |
CSD |
PDB |
Stats |
Theory |
| CONH2 |
49 |
43 |
|
|
| imidazole |
* |
68 |
|
|
| guanidinium |
* |
21 |
|
|
* This search has not been done.
|
|
