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charged quinoline uncharged quinoline

uncharged quinoline



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 9982 3983    
any polar X-H (X= N,O or S) 3350 853  
* 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 4960 1246  
methylene 1730 371  
methyl 1942 519  
any aromatic C-H 4989 712  
substituted aromatic carbon 2481 88  
phenyl 1419 298  
* 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 1637 307  
any uncharged NH 1234 *  
any cationic NH 103 *  
aromatic cationic N-H 60 *  
amide NH 814 124  
uncharged C(sp2)/C(ar)-NH2 92 *  
cationic RNH3 8 19  
cationic R3NH   *    
* 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 1704 533  
alcohol OH 362 51  
phenol OH 360 41  
water 324 441  
* 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 3316 15  
cyano 123    
pyramidal R3N 8 *  
uncharged planar R3N 96 2  
cationic planar R3N 2    
any terminal O 1478 700  
any C=O 1427 700  
amide C=O 706 280  
ester C=O 201    
carboxylate 29 295  
aliphatic ether 33    
linking O in esters 172    
aromatic O 28    
sulfoxide/sulfone O 35    
nitro 230 *  
* 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 314 52  
any C=S 53    
aliphatic thioether 21 37  
aromatic S 74    
* 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 880    
any C-Cl 889    
any C-Br 222    
any C-I 115    
chloride ion 20    
bromide ion 2    
iodide ion 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

Alkali Metal
 Links to statistical data  Links to theoretical energy data
Contact Group CSD PDB Stats Theory
lithium ion        
sodium ion 1    
potassium ion 6    
rubidium ion 6    
cesuim ion 1    
* 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 25 59  
imidazole * 47    
guanidinium * 44    
* This search has not been done.




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