Geometry & MOs

Info

ID:	443265
PubChem CID:	135258316
Reduced:	ClNO2C7H8 (2)
Stoich.:	ABC2D7E8 (2)
Weight, g/mol:	175.099714
ΔH_f, kcal/mol:	-166.8
Dipole, Da:	6.88
IP(EA), eV:	-9.17(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-propyl-1-benzofuran-5-amine

Drug info:

PubChemData

Smile

CC1C(OC(OC(O1)(C)C)O)N2C=NC3=CC(=C(C=C32)Cl)Cl

DOS

IR

Vibrations