|
1H-1,2,3-Triazol-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 |
9941 |
770 |
|
|
| any polar X-H (X= N,O or S) |
1121 |
291 |
|
|
* 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 |
4965 |
170 |
|
|
| methylene |
842 |
45 |
|
|
| methyl |
1754 |
55 |
|
|
| any aromatic C-H |
4986 |
114 |
|
|
| substituted aromatic carbon |
905 |
6 |
|
|
| phenyl |
1393 |
29 |
|
|
* 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 |
363 |
79 |
|
|
| any uncharged NH |
135 |
* |
|
|
| any cationic NH |
27 |
* |
|
|
| aromatic cationic N-H |
6 |
* |
|
|
| amide NH |
73 |
19 |
|
|
| uncharged C(sp2)/C(ar)-NH2 |
33 |
* |
|
|
| cationic RNH3 |
3 |
11 |
|
|
| 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 |
758 |
210 |
|
|
| alcohol OH |
142 |
11 |
|
|
| phenol OH |
83 |
24 |
|
|
| water |
138 |
175 |
|
|
* 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 |
3194 |
4 |
|
|
| cyano |
83 |
|
|
|
| pyramidal R3N |
6 |
* |
|
|
| uncharged planar R3N |
44 |
|
|
|
| cationic planar R3N |
|
2 |
|
|
|
| any terminal O |
992 |
71 |
|
|
| any C=O |
612 |
71 |
|
|
| amide C=O |
86 |
24 |
|
|
| ester C=O |
337 |
|
|
|
| carboxylate |
17 |
33 |
|
|
| aliphatic ether |
41 |
|
|
|
| linking O in esters |
154 |
|
|
|
| aromatic O |
2 |
|
|
|
| sulfoxide/sulfone O |
17 |
|
|
|
| nitro |
259 |
* |
|
|
* 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 |
146 |
8 |
|
|
| any C=S |
18 |
|
|
|
| aliphatic thioether |
6 |
2 |
|
|
| aromatic S |
39 |
|
|
|
* 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 |
318 |
|
|
|
| any C-Cl |
321 |
|
|
|
| any C-Br |
123 |
|
|
|
| any C-I |
94 |
|
|
|
| chloride ion |
42 |
|
|
|
| bromide ion |
6 |
|
|
|
| iodide ion |
22 |
|
|
|
* 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 |
|
|
|
| potassium ion |
5 |
|
|
|
| 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 |
11 |
22 |
|
|
| imidazole |
* |
17 |
|
|
| guanidinium |
* |
16 |
|
|
* This search has not been done.
|
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