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aliphatic-aliphatic amide aliphatic-aromatic amide aromatic-aliphatic amide aromatic-aromatic amide

aliphatic-aliphatic amide



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 9993 9994    
any polar X-H (X= N,O or S) 4996 9194  
* 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 4996 3707  
methylene 1998 874  
methyl 1998 981  
any aromatic C-H 4996 1619  
substituted aromatic carbon 643 55  
phenyl 1427 500  
* 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 4991 2549  
any uncharged NH 4996 *  
any cationic NH 1015 *  
aromatic cationic N-H 30 *  
amide NH 1665 956
uncharged C(sp2)/C(ar)-NH2 251 *  
cationic RNH3 512 595
cationic R3NH 5 *  
* 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 4975 6396  
alcohol OH 1678 376
phenol OH 275 681
water 1860 5339
* 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 300 36  
cyano 171    
pyramidal R3N 28 *  
uncharged planar R3N 143 9  
cationic planar R3N        
any terminal O 4996 2882  
any C=O 4996 2882
amide C=O 1665 1683
ester C=O 937    
carboxylate 887 787
aliphatic ether 109    
linking O in esters 241    
aromatic O 19    
sulfoxide/sulfone O 83    
nitro 98 *  
* 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 403 161  
any C=S 44    
aliphatic thioether 54 86
aromatic S 14    
* 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 503    
any C-Cl 577    
any C-Br 122    
any C-I 53    
chloride ion 187    
bromide ion 29    
iodide ion 14    
* 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 3    
sodium ion 3    
potassium ion 14    
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 397 1166  
imidazole * 579  
guanidinium * 742    
* This search has not been done.




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