Geometry & MOs

Info

ID:	206958
PubChem CID:	80324751
Reduced:	NSC6H7 (2)
Stoich.:	ABC6D7 (2)
Weight, g/mol:	292.106791
ΔH_f, kcal/mol:	53.45
Dipole, Da:	1.33
IP(EA), eV:	-8.85(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-[3-[(4-methyl-1,3-thiazol-2-yl)methylsulfanyl]phenyl]ethanamine

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)SCC2=NC=CS2)N

DOS

IR

Vibrations