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acetyl

acetyl



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 2453 2265    
any polar X-H (X= N,O or S) 1998 870  
* 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 1998 749  
methylene 1249 180  
methyl 1249 232  
any aromatic C-H 1988 365  
substituted aromatic carbon 1427 91  
phenyl 999 101  
* 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 1998 386  
any uncharged NH 1998 *  
any cationic NH 276 *  
aromatic cationic N-H 64 *  
amide NH 438 96
uncharged C(sp2)/C(ar)-NH2 300 *  
cationic RNH3 39 20
cationic R3NH 16 *  
* 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 1994 437  
alcohol OH 1388 30
phenol OH 1651 46
water 891 362
* 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 1662 47  
cyano 830    
pyramidal R3N 77 *  
uncharged planar R3N 596    
cationic planar R3N 69    
any terminal O 1998 210  
any C=O 1998 210
amide C=O 650 92
ester C=O 1249    
carboxylate 140 43
aliphatic ether 337    
linking O in esters 815    
aromatic O 279    
sulfoxide/sulfone O 218    
nitro 1415 *  
* 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 2498 61  
any C=S 444    
aliphatic thioether 71 10
aromatic S 493    
* 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 1998    
any C-Cl 1631    
any C-Br 935    
any C-I 167    
chloride ion 180    
bromide ion 82    
iodide ion 80    
* 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 1    
sodium ion 28    
potassium ion 51    
rubidium ion 4    
cesuim ion 24    
* 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 296 115  
imidazole * 132  
guanidinium * 19    
* This search has not been done.



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