Geometry & MOs

Info

ID:	293503
PubChem CID:	117391915
Reduced:	NSO2C13H21 (1)
Stoich.:	ABC2D13E21 (1)
Weight, g/mol:	255.1293
ΔH_f, kcal/mol:	-77.34
Dipole, Da:	2.99
IP(EA), eV:	-7.95(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,6-dimethoxy-4-propan-2-ylsulfanylphenyl)ethanamine

Drug info:

PubChemData

Smile

CC(C)(CC1=CC(=C(C=C1OC)SC)OC)N

DOS

IR

Vibrations