Geometry & MOs

Info

ID:	249143
PubChem CID:	103087197
Reduced:	FNSC11H16 (1)
Stoich.:	ABCD11E16 (1)
Weight, g/mol:	223.139471
ΔH_f, kcal/mol:	-39.45
Dipole, Da:	3.65
IP(EA), eV:	-8.56(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethyl-N-(4-methylsulfanylbutyl)aniline

Drug info:

PubChemData

Smile

CSCCCCNC1=CC(=CC=C1)F

DOS

IR

Vibrations