Geometry & MOs

Info

ID:	10123
PubChem CID:	97744
Reduced:	OC10H12 (1)
Stoich.:	AB10C12 (1)
Weight, g/mol:	148.088815
ΔH_f, kcal/mol:	-30.07
Dipole, Da:	3.03
IP(EA), eV:	-9.51(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenylbutan-2-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations