|
4-hydroxyphenyl (Y)
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 |
4992 |
9940 |
|
|
| any polar X-H (X= N,O or S) |
2993 |
9991 |
|
|
* 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 |
3298 |
9991 |
|
|
| methylene |
1661 |
3320 |
|
|
| methyl |
900 |
2377 |
|
|
| any aromatic C-H |
3320 |
3316 |
|
|
| substituted aromatic carbon |
940 |
1188 |
|
|
| phenyl |
318 |
559 |
|
|
* 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 |
858 |
2403 |
|
|
| any uncharged NH |
311 |
* |
|
|
| any cationic NH |
326 |
* |
|
|
| aromatic cationic N-H |
11 |
* |
|
|
| amide NH |
112 |
633 |
|
|
| uncharged C(sp2)/C(ar)-NH2 |
68 |
* |
|
|
| cationic RNH3 |
162 |
180 |
|
|
| 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 |
2129 |
9469 |
|
|
| alcohol OH |
156 |
2348 |
|
|
| phenol OH |
738 |
230 |
|
|
| water |
698 |
6891 |
|
|
* 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 |
172 |
1609 |
|
|
| cyano |
15 |
145 |
|
|
| pyramidal R3N |
11 |
* |
|
|
| uncharged planar R3N |
49 |
745 |
|
|
| cationic planar R3N |
|
625 |
|
|
|
| any terminal O |
1408 |
4286 |
|
|
| any C=O |
1275 |
4286 |
|
|
| amide C=O |
276 |
1162 |
|
|
| ester C=O |
120 |
332 |
|
|
| carboxylate |
172 |
1920 |
|
|
| aliphatic ether |
10 |
4 |
|
|
| linking O in esters |
53 |
193 |
|
|
| aromatic O |
5 |
113 |
|
|
| sulfoxide/sulfone O |
16 |
20 |
|
|
| nitro |
32 |
* |
|
|
* 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 |
90 |
897 |
|
|
| any C=S |
15 |
10 |
|
|
| aliphatic thioether |
4 |
348 |
|
|
| aromatic S |
8 |
198 |
|
|
* 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 |
45 |
576 |
|
|
| any C-Cl |
118 |
602 |
|
|
| any C-Br |
23 |
80 |
|
|
| any C-I |
|
24 |
|
|
| chloride ion |
53 |
41 |
|
|
| bromide ion |
15 |
3 |
|
|
| iodide ion |
27 |
1 |
|
|
* 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 |
16 |
15 |
|
|
| potassium ion |
|
6 |
|
|
| 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 |
34 |
430 |
|
|
| imidazole |
* |
195 |
|
|
| guanidinium |
* |
230 |
|
|
* This search has not been done.
|
|
