Geometry & MOs

Info

ID:	32346
PubChem CID:	6436648
Reduced:	OC9H17 (2)
Stoich.:	AB9C17 (2)
Weight, g/mol:	220.073559
ΔH_f, kcal/mol:	-145.95
Dipole, Da:	1.79
IP(EA), eV:	-9.51(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (Z)-3-(1,3-benzodioxol-5-yl)prop-2-enoate

Drug info:

PubChemData

Smile

CCC(C)CCCC/C=C/CCCCCCC(=O)OC

DOS

IR

Vibrations