Geometry & MOs

Info

ID:	293500
PubChem CID:	117391902
Reduced:	N3C16H21 (1)
Stoich.:	A3B16C21 (1)
Weight, g/mol:	255.1293
ΔH_f, kcal/mol:	37.86
Dipole, Da:	3.16
IP(EA), eV:	-8.68(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-dimethoxy-3-methylsulfanylphenyl)-2-methylpropan-2-amine

Drug info:

PubChemData

Smile

CC1CCC(CC1)C2=CC=CC(=C2)C3=C(NN=C3)N

DOS

IR

Vibrations