Geometry & MOs

Info

ID:	249138
PubChem CID:	103087120
Reduced:	SN5C8H15 (1)
Stoich.:	AB5C8D15 (1)
Weight, g/mol:	283.1606
ΔH_f, kcal/mol:	63.01
Dipole, Da:	6.62
IP(EA), eV:	-8.88(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methylsulfanylbutan-1-amine

Drug info:

PubChemData

Smile

CC(C1=NN=NN1C2CCSC2)NC

DOS

IR

Vibrations