|
3,5-dinitrophenyl
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 |
9942 |
|
|
|
| any polar X-H (X= N,O or S) |
2250 |
|
|
|
* 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 |
4991 |
|
|
|
| methylene |
1996 |
|
|
|
| methyl |
1996 |
|
|
|
| any aromatic C-H |
4991 |
|
|
|
| substituted aromatic carbon |
2495 |
|
|
|
| phenyl |
818 |
|
|
|
* 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 |
1221 |
|
|
|
| any uncharged NH |
530 |
|
|
|
| any cationic NH |
243 |
|
|
|
| aromatic cationic N-H |
75 |
|
|
|
| amide NH |
123 |
|
|
|
| uncharged C(sp2)/C(ar)-NH2 |
177 |
|
|
|
| cationic RNH3 |
56 |
|
|
|
| cationic R3NH |
10 |
|
|
|
* 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 |
1029 |
|
|
|
| alcohol OH |
107 |
|
|
|
| phenol OH |
56 |
|
|
|
| water |
249 |
|
|
|
* 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 |
261 |
|
|
|
| cyano |
117 |
|
|
|
| pyramidal R3N |
27 |
|
|
|
| uncharged planar R3N |
129 |
|
|
|
| cationic planar R3N |
|
|
|
|
|
| any terminal O |
4991 |
|
|
|
| any C=O |
2347 |
|
|
|
| amide C=O |
216 |
|
|
|
| ester C=O |
861 |
|
|
|
| carboxylate |
370 |
|
|
|
| aliphatic ether |
59 |
|
|
|
| linking O in esters |
369 |
|
|
|
| aromatic O |
24 |
|
|
|
| sulfoxide/sulfone O |
43 |
|
|
|
| nitro |
2495 |
|
|
|
* 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 |
316 |
|
|
|
| any C=S |
28 |
|
|
|
| aliphatic thioether |
3 |
|
|
|
| aromatic S |
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
|
Halo/Halide
|
|
Links to statistical data |
Links to theoretical energy data |
| Contact Group |
CSD |
PDB |
Stats |
Theory |
| any C-F |
53 |
|
|
|
| any C-Cl |
207 |
|
|
|
| any C-Br |
110 |
|
|
|
| any C-I |
89 |
|
|
|
| chloride ion |
20 |
|
|
|
| bromide ion |
12 |
|
|
|
| iodide ion |
4 |
|
|
|
* 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 |
|
|
|
|
| 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 |
197 |
|
|
|
| imidazole |
* |
* |
|
|
| guanidinium |
* |
* |
|
|
* This search has not been done.
|
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