Geometry & MOs

Info

ID:	292578
PubChem CID:	117355886
Reduced:	NSO2C12H19 (1)
Stoich.:	ABC2D12E19 (1)
Weight, g/mol:	241.11365
ΔH_f, kcal/mol:	-62.74
Dipole, Da:	2.42
IP(EA), eV:	-8.26(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,5-dimethoxy-3-methylsulfanylphenyl)propan-2-amine

Drug info:

PubChemData

Smile

CC(C)(C1=C(C=CC(=C1SC)OC)OC)N

DOS

IR

Vibrations