Geometry & MOs

Info

ID:	338764
PubChem CID:	127259775
Reduced:	Cl2O3H10C15 (1)
Stoich.:	A2B3C10D15 (1)
Weight, g/mol:	374.01537
ΔH_f, kcal/mol:	-81.53
Dipole, Da:	4.37
IP(EA), eV:	-9.48(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-1-(4-bromo-1,3-benzodioxol-5-yl)prop-1-en-2-yl] 2-phenylacetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C(=C\C2=CC(=C(C(=C2)Cl)O)Cl)/C(=O)O

DOS

IR

Vibrations