Geometry & MOs

Info

ID:	8070
PubChem CID:	74878
Reduced:	OC11H14 (1)
Stoich.:	AB11C14 (1)
Weight, g/mol:	162.104465
ΔH_f, kcal/mol:	-45.6
Dipole, Da:	3.88
IP(EA), eV:	-9.07(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4,5-trimethylphenyl)ethanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1C)C(=O)C)C

DOS

IR

Vibrations