Geometry & MOs

Info

ID:	292071
PubChem CID:	114279699
Reduced:	IO2F5H6C11 (1)
Stoich.:	AB2C5D6E11 (1)
Weight, g/mol:	345.05896
ΔH_f, kcal/mol:	-283.43
Dipole, Da:	5.45
IP(EA), eV:	-9.39(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-iodo-2,3-dihydro-1-benzofuran-7-yl)hexan-1-amine

Drug info:

PubChemData

Smile

C1COC2=C1C=C(C=C2C(=O)C(C(F)(F)F)(F)F)I

DOS

IR

Vibrations