Geometry & MOs

Info

ID:	204876
PubChem CID:	80024683
Reduced:	FNSC14H22 (1)
Stoich.:	ABCD14E22 (1)
Weight, g/mol:	241.130049
ΔH_f, kcal/mol:	-44.2
Dipole, Da:	2.13
IP(EA), eV:	-8.76(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(2-fluorophenyl)ethyl-methylamino]butane-1-thiol

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1F)N(C)CCCCCS

DOS

IR

Vibrations