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phenyl (F)

phenyl (F)



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 9985 9962    
any polar X-H (X= N,O or S) 4978 6057  
* 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 4992 9524  
methylene 1997 2956  
methyl 1997 2820  
any aromatic C-H 4992 3328  
substituted aromatic carbon 2496 2445  
phenyl 1426 393  
* 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 4975 1591  
any uncharged NH 4078 *  
any cationic NH 480 *  
aromatic cationic N-H 111 *  
amide NH 1625 242  
uncharged C(sp2)/C(ar)-NH2 360 *  
cationic RNH3 106 38  
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 4964 4290  
alcohol OH 3308 1187  
phenol OH 1167 149  
water 2110 2954  
* 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 3325 1873  
cyano 2853 126  
pyramidal R3N 402 *  
uncharged planar R3N 2494 649  
cationic planar R3N 214 51  
any terminal O 4992 2308  
any C=O 4959 2308  
amide C=O 1623 545  
ester C=O 1982 405  
carboxylate 1373 760  
aliphatic ether 2339    
linking O in esters 1941 168  
aromatic O 451 99  
sulfoxide/sulfone O 798 9  
nitro 2485 *  
* 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 9980 641  
any C=S 1745 23  
aliphatic thioether 533 258  
aromatic S 692 267  
* 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 4945 779  
any C-Cl 4964 666  
any C-Br 2458 93  
any C-I 512 31  
chloride ion 1285 25  
bromide ion 1086 2  
iodide ion 332 2  
* 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 18    
sodium ion 36 22  
potassium ion 95 15  
rubidium ion        
cesuim ion 24    
* 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 350 180  
imidazole * 141    
guanidinium * 166    
* This search has not been done.



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