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Database Statistics

  1. Aromatic Hydrocarbons
  2. N-containing Aromatic Hydrocarbons
  3. O-containing Aromatic Hydrocarbons
  4. S-containing Aromatic Hydrocarbons
  5. Saturated Cyclic
  6. Unsaturated Cyclic
  7. Saturated Heterocyclic
  8. With Functional Groups
  9. Organoelement Compounds
 

 
 
 
 
 
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Class of Compounds Structures Exp. deltaC Exp. JC
Total: 165,043 2,019,759 81,530

Aromatic Hydrocarbons

93,748 1,165,547 54,102

Monosubstituted benzenes

40,282 453,376 25,101

ortho-Disubstituted benzenes

10,757 134,242 5,525

meta-Disubstituted benzenes

1,955 21,749 1,561

para-Disubstituted benzenes

15,907 204,622 10,245

1,2,3-Trisubstituted benzenes

2,237 29,313 1,094

1,2,4-Trisubstituted benzenes

7,990 141,221 4,037

1,3,5-Trisubstituted benzenes

610 8,081 188

1,2,3,4-Tetrasubstituted benzenes

1,682 30,405 675

1,2,3,5-Tetrasubstituted benzenes

4,340 79,126 2,615

1,2,4,5-Tetrasubstituted benzenes

2,683 46,292 865

Pentasubstituted benzenes

2,870 56,851 1,200

Hexasubstituted benzenes

1,148 19,116 376

Naphthalenes

1,931 27,016 1,394

Anthracenes

170 2,267 308

Phenanthrenes

279 4,600 56

Pyrenes

88 1,593 22

Fluorenes

380 5,292 206

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