Geometry & MOs

Info

ID:	205135
PubChem CID:	80059498
Reduced:	FNSC15H16 (1)
Stoich.:	ABCD15E16 (1)
Weight, g/mol:	279.089327
ΔH_f, kcal/mol:	-4.4
Dipole, Da:	2.06
IP(EA), eV:	-8.7(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-fluoro-2-(3-fluorophenyl)sulfanylphenyl]methyl]ethanamine

Drug info:

PubChemData

Smile

CCNCC1=CC=C(C=C1)SC2=CC=CC(=C2)F

DOS

IR

Vibrations