Geometry & MOs

Info

ID:	2277
PubChem CID:	6544
Reduced:	OC9H14 (1)
Stoich.:	AB9C14 (1)
Weight, g/mol:	138.104465
ΔH_f, kcal/mol:	-60.42
Dipole, Da:	5.36
IP(EA), eV:	-9.75(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5,5-trimethylcyclohex-2-en-1-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations