Geometry & MOs

Info

ID:	206957
PubChem CID:	80324750
Reduced:	NSC7H9 (2)
Stoich.:	ABC7D9 (2)
Weight, g/mol:	250.059841
ΔH_f, kcal/mol:	33.72
Dipole, Da:	1.4
IP(EA), eV:	-8.54(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(1,3-thiazol-2-ylmethylsulfanyl)phenyl]ethanamine

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)CSC2=CC=C(C=C2)C(C)N)C

DOS

IR

Vibrations