Geometry & MOs

Info

ID:	326986
PubChem CID:	126688801
Reduced:	OSH8C9 (1)
Stoich.:	ABC8D9 (1)
Weight, g/mol:	182.13068
ΔH_f, kcal/mol:	10.43
Dipole, Da:	0.45
IP(EA), eV:	-8.59(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethenoxy-2-methylpropane;penta-1,4-dien-3-one

Drug info:

PubChemData

Smile

CC1=C(C=CS1)C2=CC=CO2

DOS

IR

Vibrations