Geometry & MOs

Info

ID:	289578
PubChem CID:	104359690
Reduced:	ClON3C15H22 (1)
Stoich.:	ABC3D15E22 (1)
Weight, g/mol:	268.134241
ΔH_f, kcal/mol:	-24.72
Dipole, Da:	3.91
IP(EA), eV:	-8.3(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(5-chloro-2,3-dihydro-1-benzofuran-7-yl)methyl]-N'-propylethane-1,2-diamine

Drug info:

PubChemData

Smile

C1COC2=C1C=C(C=C2CN3CCN(CC3)CCN)Cl

DOS

IR

Vibrations