![]() |
Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology |
|
|
You are here: Comparisons > Energy > Similar molecules > Sets of tautomers |
formula | sketch | Energy (kJ mol-1) | Name | difference | |||
---|---|---|---|---|---|---|---|
A | B | calculated | experiment | A | B | ||
C3H4 | ![]() |
![]() |
-2 | -7 | allene | propyne | 4 |
C3H6O | ![]() |
![]() |
-107 | -110 | Oxetane | Propanal | 3 |
C4H8 | ![]() |
![]() |
-41 | -33 | cyclobutane | 1-Butene | -9 |