|
furan
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 |
9955 |
1034 |
|
|
any polar X-H (X= N,O or S) |
3194 |
303 |
|
|
* 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 |
4978 |
385 |
|
|
methylene |
1953 |
89 |
|
|
methyl |
1983 |
173 |
|
|
any aromatic C-H |
4967 |
173 |
|
|
substituted aromatic carbon |
2251 |
22 |
|
|
phenyl |
1375 |
54 |
|
|
* 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 |
1266 |
109 |
|
|
any uncharged NH |
569 |
* |
|
|
any cationic NH |
171 |
* |
|
|
aromatic cationic N-H |
29 |
* |
|
|
amide NH |
208 |
23 |
|
|
uncharged C(sp2)/C(ar)-NH2 |
101 |
* |
|
|
cationic RNH3 |
5 |
5 |
|
|
cationic R3NH |
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
O-H
|
Links to statistical data |
Links to theoretical energy data |
Contact Group |
CSD |
PDB |
Stats |
Theory |
any OH |
1926 |
175 |
|
|
alcohol OH |
511 |
22 |
|
|
phenol OH |
144 |
10 |
|
|
water |
428 |
143 |
|
|
* 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 |
1157 |
8 |
|
|
cyano |
291 |
|
|
|
pyramidal R3N |
20 |
* |
|
|
uncharged planar R3N |
140 |
1 |
|
|
cationic planar R3N |
4 |
|
|
|
any terminal O |
4978 |
143 |
|
|
any C=O |
4264 |
143 |
|
|
amide C=O |
477 |
68 |
|
|
ester C=O |
1494 |
|
|
|
carboxylate |
102 |
25 |
|
|
aliphatic ether |
126 |
|
|
|
linking O in esters |
628 |
|
|
|
aromatic O |
3328 |
|
|
|
sulfoxide/sulfone O |
76 |
|
|
|
nitro |
656 |
* |
|
|
* 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 |
979 |
32 |
|
|
any C=S |
271 |
|
|
|
aliphatic thioether |
21 |
11 |
|
|
aromatic S |
105 |
|
|
|
* 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 |
680 |
|
|
|
any C-Cl |
664 |
|
|
|
any C-Br |
235 |
|
|
|
any C-I |
71 |
|
|
|
chloride ion |
58 |
|
|
|
bromide ion |
24 |
|
|
|
iodide ion |
34 |
|
|
|
* 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 |
2 |
|
|
|
potassium ion |
9 |
|
|
|
rubidium ion |
1 |
|
|
|
cesuim ion |
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
Amino acid
|
Links to statistical data |
Links to theoretical energy data |
Contact Group |
CSD |
PDB |
Stats |
Theory |
CONH2 |
81 |
34 |
|
|
imidazole |
* |
44 |
|
|
guanidinium |
* |
16 |
|
|
* This search has not been done.
|
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