Geometry & MOs

Info

ID:	289600
PubChem CID:	104359971
Reduced:	ClNOC16H22 (1)
Stoich.:	ABCD16E22 (1)
Weight, g/mol:	285.03644
ΔH_f, kcal/mol:	-46.56
Dipole, Da:	3.53
IP(EA), eV:	-8.69(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-bromo-2,3-dihydro-1-benzofuran-7-yl)methylamino]propan-2-ol

Drug info:

PubChemData

Smile

C1CCCC(CC1)NCC2=CC(=CC3=C2OCC3)Cl

DOS

IR

Vibrations