Geometry & MOs

Info

ID:	3749
PubChem CID:	10108
Reduced:	OC9H14 (1)
Stoich.:	AB9C14 (1)
Weight, g/mol:	138.104465
ΔH_f, kcal/mol:	-59.65
Dipole, Da:	3.4
IP(EA), eV:	-9.66(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5,5-trimethylcyclohex-3-en-1-one

Drug info:

PubChemData

Smile

CC1=CC(CC(=O)C1)(C)C

DOS

IR

Vibrations