Geometry & MOs

Info

ID:	202925
PubChem CID:	79746547
Reduced:	ON3C16H19 (1)
Stoich.:	AB3C16D19 (1)
Weight, g/mol:	325.04775
ΔH_f, kcal/mol:	-6.35
Dipole, Da:	3.67
IP(EA), eV:	-8.29(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-bromo-4-fluorophenyl)-(3-methylfuran-2-yl)methyl]propan-1-amine

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=N1)NC2CCC3=C2C=CC(=C3)N

DOS

IR

Vibrations