Geometry & MOs

Info

ID:	206107
PubChem CID:	80204443
Reduced:	FNSO2C14H20 (1)
Stoich.:	ABCD2E14F20 (1)
Weight, g/mol:	285.098749
ΔH_f, kcal/mol:	-131.03
Dipole, Da:	8.01
IP(EA), eV:	-9.48(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-fluoro-4-methylphenyl)ethyl]-1-benzothiophen-5-amine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(C)NC2CCS(=O)(=O)CC2)F

DOS

IR

Vibrations