Geometry & MOs

Info

ID:	205093
PubChem CID:	80054769
Reduced:	OSN3C13H21 (1)
Stoich.:	ABC3D13E21 (1)
Weight, g/mol:	216.07212
ΔH_f, kcal/mol:	-33.81
Dipole, Da:	4.69
IP(EA), eV:	-8.93(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-4-pyridin-4-ylsulfanylaniline

Drug info:

PubChemData

Smile

CC(C)NC(C)(CCSC1=CC=NC=C1)C(=O)N

DOS

IR

Vibrations