|
indol-3-yl (W)
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 |
9981 |
9892 |
|
|
| any polar X-H (X= N,O or S) |
1651 |
9960 |
|
|
* 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 |
4919 |
9989 |
|
|
| methylene |
1729 |
3316 |
|
|
| methyl |
1247 |
2635 |
|
|
| any aromatic C-H |
4984 |
2870 |
|
|
| substituted aromatic carbon |
1273 |
1833 |
|
|
| phenyl |
352 |
565 |
|
|
* 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 |
1068 |
2436 |
|
|
| any uncharged NH |
827 |
* |
|
|
| any cationic NH |
101 |
* |
|
|
| aromatic cationic N-H |
14 |
* |
|
|
| amide NH |
82 |
316 |
|
|
| uncharged C(sp2)/C(ar)-NH2 |
18 |
* |
|
|
| cationic RNH3 |
53 |
108 |
|
|
| 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 |
583 |
7707 |
|
|
| alcohol OH |
141 |
2733 |
|
|
| phenol OH |
31 |
100 |
|
|
| water |
211 |
4874 |
|
|
* 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 |
162 |
2097 |
|
|
| cyano |
56 |
69 |
|
|
| pyramidal R3N |
8 |
* |
|
|
| uncharged planar R3N |
101 |
592 |
|
|
| cationic planar R3N |
23 |
138 |
|
|
|
| any terminal O |
1604 |
4808 |
|
|
| any C=O |
1270 |
4808 |
|
|
| amide C=O |
240 |
1344 |
|
|
| ester C=O |
156 |
280 |
|
|
| carboxylate |
174 |
2405 |
|
|
| aliphatic ether |
21 |
|
|
|
| linking O in esters |
83 |
145 |
|
|
| aromatic O |
5 |
34 |
|
|
| sulfoxide/sulfone O |
25 |
6 |
|
|
| nitro |
152 |
* |
|
|
* 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 |
110 |
666 |
|
|
| any C=S |
14 |
18 |
|
|
| aliphatic thioether |
9 |
315 |
|
|
| aromatic S |
10 |
171 |
|
|
* 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 |
47 |
383 |
|
|
| any C-Cl |
90 |
271 |
|
|
| any C-Br |
32 |
78 |
|
|
| any C-I |
|
12 |
|
|
| chloride ion |
34 |
11 |
|
|
| bromide ion |
10 |
|
|
|
| iodide ion |
19 |
3 |
|
|
* 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 |
|
35 |
|
|
| potassium ion |
1 |
|
|
|
| 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 |
26 |
450 |
|
|
| imidazole |
* |
81 |
|
|
| guanidinium |
* |
282 |
|
|
* This search has not been done.
|
|
