Geometry & MOs

Info

ID:	19325
PubChem CID:	561366
Reduced:	O2C11H12 (1)
Stoich.:	A2B11C12 (1)
Weight, g/mol:	176.08373
ΔH_f, kcal/mol:	-45.36
Dipole, Da:	3.72
IP(EA), eV:	-9.7(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenylmethoxybut-3-en-2-one

Drug info:

PubChemData

Smile

CC(=O)C=COCC1=CC=CC=C1

DOS

IR

Vibrations