Geometry & MOs

Info

ID:	205129
PubChem CID:	80059385
Reduced:	FNSC15H24 (1)
Stoich.:	ABCD15E24 (1)
Weight, g/mol:	261.098749
ΔH_f, kcal/mol:	-56.04
Dipole, Da:	2.01
IP(EA), eV:	-8.79(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-fluorophenyl)sulfanylethyl]-3-methylaniline

Drug info:

PubChemData

Smile

CCCCCC(C)NCCSC1=CC=CC(=C1)F

DOS

IR

Vibrations