Geometry & MOs

Info

ID:	8523
PubChem CID:	78868
Reduced:	O3C7H8 (1)
Stoich.:	A3B7C8 (1)
Weight, g/mol:	140.047344
ΔH_f, kcal/mol:	-105.99
Dipole, Da:	3.71
IP(EA), eV:	-9.65(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-3,6-dimethylpyran-4-one

Drug info:

PubChemData

Smile

CC1=CC(=O)C(=C(O1)O)C

DOS

IR

Vibrations