|
2-hydroxyphenyl
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 |
4920 |
961 |
|
|
| any polar X-H (X= N,O or S) |
3328 |
274 |
|
|
* 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 |
3328 |
386 |
|
|
| methylene |
1664 |
107 |
|
|
| methyl |
1664 |
127 |
|
|
| any aromatic C-H |
3328 |
129 |
|
|
| substituted aromatic carbon |
1997 |
20 |
|
|
| phenyl |
1248 |
45 |
|
|
* 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 |
2431 |
108 |
|
|
| any uncharged NH |
763 |
* |
|
|
| any cationic NH |
320 |
* |
|
|
| aromatic cationic N-H |
123 |
* |
|
|
| amide NH |
449 |
50 |
|
|
| uncharged C(sp2)/C(ar)-NH2 |
139 |
* |
|
|
| cationic RNH3 |
32 |
9 |
|
|
| cationic R3NH |
2 |
* |
|
|
* 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 |
3328 |
164 |
|
|
| alcohol OH |
449 |
33 |
|
|
| phenol OH |
2496 |
22 |
|
|
| water |
584 |
109 |
|
|
* 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 |
2496 |
4 |
|
|
| cyano |
298 |
|
|
|
| pyramidal R3N |
46 |
* |
|
|
| uncharged planar R3N |
295 |
|
|
|
| cationic planar R3N |
20 |
|
|
|
|
| any terminal O |
3328 |
144 |
|
|
| any C=O |
3328 |
144 |
|
|
| amide C=O |
699 |
74 |
|
|
| ester C=O |
419 |
|
|
|
| carboxylate |
333 |
24 |
|
|
| aliphatic ether |
110 |
|
|
|
| linking O in esters |
222 |
|
|
|
| aromatic O |
116 |
|
|
|
| sulfoxide/sulfone O |
55 |
|
|
|
| nitro |
278 |
* |
|
|
* 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 |
1061 |
10 |
|
|
| any C=S |
274 |
|
|
|
| aliphatic thioether |
24 |
7 |
|
|
| aromatic S |
145 |
|
|
|
* 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 |
420 |
|
|
|
| any C-Cl |
697 |
|
|
|
| any C-Br |
184 |
|
|
|
| any C-I |
34 |
|
|
|
| chloride ion |
166 |
|
|
|
| bromide ion |
47 |
|
|
|
| iodide ion |
11 |
|
|
|
* 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 |
1 |
|
|
|
| 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 |
122 |
19 |
|
|
| imidazole |
* |
26 |
|
|
| guanidinium |
* |
19 |
|
|
* This search has not been done.
|
|
