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acetone

acetone



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 9919 *    
any polar X-H (X= N,O or S) 4986 *  
* 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 4954 *  
methylene 1947 *  
methyl 1984 *  
any aromatic C-H 4978 *  
substituted aromatic carbon 2497 *  
phenyl 1398 *  
* 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 2499 *  
any uncharged NH 1324 *  
any cationic NH 139 *  
aromatic cationic N-H 40 *  
amide NH 272 *
uncharged C(sp2)/C(ar)-NH2 143 *  
cationic RNH3 8 *
cationic R3NH 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

O-H
 Links to statistical data  Links to theoretical energy data
Contact Group CSD PDB Stats Theory
any OH 3153 *  
alcohol OH 477 *
phenol OH 827 *
water 459 *
* 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 888 *  
cyano 367 *  
pyramidal R3N 44 *  
uncharged planar R3N 367 *  
cationic planar R3N 59 *  
any terminal O 4925 *  
any C=O 4952 *
amide C=O 337 *
ester C=O 510 *  
carboxylate 81 *
aliphatic ether 205 *  
linking O in esters 226 *  
aromatic O 65 *  
sulfoxide/sulfone O 86 *  
nitro 599 *  
* 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 1341 *  
any C=S 227 *  
aliphatic thioether 23 *
aromatic S 144 *  
* 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 2963 *  
any C-Cl 650 *  
any C-Br 334 *  
any C-I 70 *  
chloride ion 91 *  
bromide ion 45 *  
iodide ion 42 *  
* 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 9 *  
potassium ion 33 *  
rubidium ion 4 *  
cesuim ion 15 *  
* 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 200 *  
imidazole * *  
guanidinium * *    
* This search has not been done.



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