Geometry & MOs

Info

ID:	155084
PubChem CID:	56320664
Reduced:	INO3C19H22 (1)
Stoich.:	ABC3D19E22 (1)
Weight, g/mol:	469.03862
ΔH_f, kcal/mol:	-64.94
Dipole, Da:	5.58
IP(EA), eV:	-8.72(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-iodo-4,5-dimethoxybenzamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)CN(C)C(=O)C2=CC(=C(C=C2I)OC)OC

DOS

IR

Vibrations