Geometry & MOs

Info

ID:	22836
PubChem CID:	599055
Reduced:	OC12H12 (1)
Stoich.:	AB12C12 (1)
Weight, g/mol:	172.088815
ΔH_f, kcal/mol:	-8.18
Dipole, Da:	4.65
IP(EA), eV:	-9.52(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-3-phenylcyclopent-2-en-1-one

Drug info:

PubChemData

Smile

CC1CC(=CC1=O)C2=CC=CC=C2

DOS

IR

Vibrations