Geometry & MOs

Info

ID:	194312
PubChem CID:	78514112
Reduced:	N2O6C19H22 (1)
Stoich.:	A2B6C19D22 (1)
Weight, g/mol:	382.141638
ΔH_f, kcal/mol:	-213.38
Dipole, Da:	2.58
IP(EA), eV:	-8.82(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-ethoxyphenyl)-1-oxopropan-2-yl] 3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoate

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)N)C(=O)COC(=O)C=CC2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations