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benzene

benzene



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 9912 *    
any polar X-H (X= N,O or S) 1143 *  
* 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 4957 *  
methylene 1934 *  
methyl 1997 *  
any aromatic C-H 4945 *  
substituted aromatic carbon 2450 *  
phenyl 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

N-H
 Links to statistical data  Links to theoretical energy data
Contact Group CSD PDB Stats Theory
any NH 574 *  
any uncharged NH 308 *  
any cationic NH 37 *  
aromatic cationic N-H 12 *  
amide NH 39 *
uncharged C(sp2)/C(ar)-NH2 39 *  
cationic RNH3 2 *
cationic R3NH 4 *  
* 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 559 *  
alcohol OH 121 *
phenol OH 190 *  
water 57 *
* 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 865 *  
cyano 424 *  
pyramidal R3N 35 *  
uncharged planar R3N 402 *  
cationic planar R3N 14 *  
any terminal O 4379 *  
any C=O 1551 *
amide C=O 103 *
ester C=O 293 *  
carboxylate 19 *
aliphatic ether 134 *  
linking O in esters 138 *  
aromatic O 37 *  
sulfoxide/sulfone O 119 *  
nitro 302 *  
* 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 1530 *  
any C=S 156 *  
aliphatic thioether 14 *  
aromatic S 170 *  
* 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 4978 *  
any C-Cl 897 *  
any C-Br 276 *  
any C-I 60 *  
chloride ion 64 *  
bromide ion 38 *  
iodide ion 82 *  
* 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 8 *  
potassium ion 34 *  
rubidium ion 1 *  
cesuim 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

Amino acid
 Links to statistical data  Links to theoretical energy data
Contact Group CSD PDB Stats Theory
CONH2 15 *  
imidazole * *  
guanidinium * *    
* This search has not been done.



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