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indole

indole



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 9964 4205    
any polar X-H (X= N,O or S) 4991 1125  
* 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 4971 1777  
methylene 1980 514  
methyl 1988 696  
any aromatic C-H 4979 499  
substituted aromatic carbon 2495 78  
phenyl 1385 265  
* 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 4099 408  
any uncharged NH 3508 *  
any cationic NH 183 *  
aromatic cationic N-H 22 *  
amide NH 294 158  
uncharged C(sp2)/C(ar)-NH2 76 *  
cationic RNH3 80 35  
cationic R3NH 3 *  
* 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 1463 696  
alcohol OH 472 70
phenol OH 155 65  
water 391 561
* 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 898 52  
cyano 421    
pyramidal R3N 51 *  
uncharged planar R3N 272 8  
cationic planar R3N 52    
any terminal O 4989 746  
any C=O 4151 746
amide C=O 657 400  
ester C=O 860    
carboxylate 316 122
aliphatic ether 86    
linking O in esters 390    
aromatic O 62    
sulfoxide/sulfone O 206    
nitro 566 *  
* 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 861 76  
any C=S 87    
aliphatic thioether 25 50  
aromatic S 67    
* 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 833    
any C-Cl 748    
any C-Br 538    
any C-I 42    
chloride ion 146    
bromide ion 43    
iodide ion 67    
* 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 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 44 185  
imidazole * 132    
guanidinium * 167    
* This search has not been done.




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