Geometry & MOs

Info

ID:	164006
PubChem CID:	74381357
Reduced:	O2C7H8 (2)
Stoich.:	A2B7C8 (2)
Weight, g/mol:	248.104859
ΔH_f, kcal/mol:	-133.73
Dipole, Da:	2.41
IP(EA), eV:	-8.68(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,3-benzodioxol-5-yl)pent-1-enyl acetate

Drug info:

PubChemData

Smile

CCC(=COC(=O)C)CC1=CC2=C(C=C1)OCO2

DOS

IR

Vibrations