This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367]. The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]: InChI desc
.sdf files containing the whole conformers of cis- and trans-tetrahydropyridine (12) generated by the GMMX module on Gaussian 16. This conformational space was subjected to an ML-J-DP4 study as part o
Chemical compound data from PubChem database. IUPAC Name: 8-chlorotetradecyl acetate. Molecular Formula: C16H31ClO2. Molecular Weight: 290.9. This dataset contains...
