Geometry & MOs

Info

ID:	292072
PubChem CID:	114279710
Reduced:	INOC14H20 (1)
Stoich.:	ABCD14E20 (1)
Weight, g/mol:	357.05896
ΔH_f, kcal/mol:	-29.38
Dipole, Da:	3.78
IP(EA), eV:	-8.91(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-1-(5-iodo-2,3-dihydro-1-benzofuran-7-yl)-N-methylpropan-1-amine

Drug info:

PubChemData

Smile

CCCCCC(C1=CC(=CC2=C1OCC2)I)N

DOS

IR

Vibrations