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aliphatic-aliphatic ester aliphatic-aromatic ester aromatic-aliphatic ester aromatic-aromatic ester

aliphatic-aromatic ester



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 9943 381    
any polar X-H (X= N,O or S) 3761 137  
* 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 4969 151  
methylene 1998 29  
methyl 1998 58  
any aromatic C-H 4996 65  
substituted aromatic carbon 2498 10  
phenyl 1427 21  
* 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 1586 62  
any uncharged NH 1005 *  
any cationic NH 270 *  
aromatic cationic N-H 29 *  
amide NH 234 17  
uncharged C(sp2)/C(ar)-NH2 239 *  
cationic RNH3 103 3  
cationic R3NH 12 *  
* 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 2168 80  
alcohol OH 677 11  
phenol OH 567 6  
water 406 63  
* 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 931    
cyano 354    
pyramidal R3N 12 *  
uncharged planar R3N 216 1  
cationic planar R3N 37    
any terminal O 4991 44  
any C=O 4982 44  
amide C=O 284 26  
ester C=O 1992    
carboxylate 28 9  
aliphatic ether 104    
linking O in esters 1998    
aromatic O 42    
sulfoxide/sulfone O 64    
nitro 2097 *  
* 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 552 9  
any C=S 60    
aliphatic thioether 20 5  
aromatic S 94    
* 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 1052    
any C-Cl 1200    
any C-Br 1007    
any C-I 142    
chloride ion 25    
bromide ion 8    
iodide ion 6    
* 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 2    
sodium ion 2    
potassium ion 1    
rubidium ion        
cesuim ion 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

Amino acid
 Links to statistical data  Links to theoretical energy data
Contact Group CSD PDB Stats Theory
CONH2 38 14  
imidazole * 9    
guanidinium * 12    
* This search has not been done.




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