Geometry & MOs

Info

ID:	24003
PubChem CID:	607404
Reduced:	NSO3C12H19 (1)
Stoich.:	ABC3D12E19 (1)
Weight, g/mol:	257.108565
ΔH_f, kcal/mol:	-98.8
Dipole, Da:	4.0
IP(EA), eV:	-8.13(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,5-dimethoxy-4-methylsulfinylphenyl)propan-2-amine

Drug info:

PubChemData

Smile

CC(CC1=CC(=C(C=C1OC)S(=O)C)OC)N

DOS

IR

Vibrations