Geometry & MOs

Info

ID:	293544
PubChem CID:	117392743
Reduced:	ClNO2C13H18 (1)
Stoich.:	ABC2D13E18 (1)
Weight, g/mol:	255.102607
ΔH_f, kcal/mol:	-82.51
Dipole, Da:	1.58
IP(EA), eV:	-8.8(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chloro-7-methoxy-2-methyl-2,3-dihydro-1-benzofuran-5-yl)propan-2-amine

Drug info:

PubChemData

Smile

CCC1=C(C2=C(C=C1CC(C)(C)N)OCO2)Cl

DOS

IR

Vibrations