Geometry & MOs

Info

ID:	5094
PubChem CID:	12578
Reduced:	OC11H14 (1)
Stoich.:	AB11C14 (1)
Weight, g/mol:	162.104465
ΔH_f, kcal/mol:	-37.56
Dipole, Da:	3.88
IP(EA), eV:	-9.67(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-propan-2-ylphenyl)ethanone

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations