Geometry & MOs

Info

ID:	289650
PubChem CID:	104363521
Reduced:	ClNO2C17H20 (1)
Stoich.:	ABC2D17E20 (1)
Weight, g/mol:	365.0182
ΔH_f, kcal/mol:	-49.01
Dipole, Da:	3.41
IP(EA), eV:	-8.54(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bromophenyl)-3-(5-chloro-2,3-dihydro-1-benzofuran-7-yl)propan-2-amine

Drug info:

PubChemData

Smile

CCCNC(CC1=CC(=CC2=C1OCC2)Cl)C3=CC=CO3

DOS

IR

Vibrations