Geometry & MOs

Info

ID:	211656
PubChem CID:	81049164
Reduced:	O2N3C16H23 (1)
Stoich.:	A2B3C16D23 (1)
Weight, g/mol:	221.121592
ΔH_f, kcal/mol:	-73.83
Dipole, Da:	4.43
IP(EA), eV:	-8.74(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-fluoro-1-benzofuran-3-yl)ethyl]propan-2-amine

Drug info:

PubChemData

Smile

CC(CC(=O)O)C1CCCN(C1)C2=NC=NC3=C2CCC3

DOS

IR

Vibrations