Geometry & MOs

Info

ID:	257876
PubChem CID:	103148932
Reduced:	F2N2O2C13H20 (1)
Stoich.:	A2B2C2D13E20 (1)
Weight, g/mol:	349.0489
ΔH_f, kcal/mol:	-168.08
Dipole, Da:	4.55
IP(EA), eV:	-9.03(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-2,3-dihydro-1-benzofuran-7-yl)-4-(2,2-difluoroethoxy)butan-2-amine

Drug info:

PubChemData

Smile

CCCOC1=CN=CC(=C1)C(CCOCC(F)F)N

DOS

IR

Vibrations