Geometry & MOs

Info

ID:	433279
PubChem CID:	135173416
Reduced:	SO2N5C29H29 (1)
Stoich.:	AB2C5D29E29 (1)
Weight, g/mol:	168.07212
ΔH_f, kcal/mol:	42.01
Dipole, Da:	4.96
IP(EA), eV:	-8.4(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-(methylaminosulfanyl)aniline

Drug info:

PubChemData

Smile

CN(C)C(=O)C1=CC=CC(=C1)C2=CC(=C(C=C2)OC)SNC3=CC=CC(=C3)NC(=NC4=CC=CC=C4)N

DOS

IR

Vibrations