Geometry & MOs

Info

ID:	8848
PubChem CID:	82461
Reduced:	NSC5H6 (2)
Stoich.:	ABC5D6 (2)
Weight, g/mol:	224.044191
ΔH_f, kcal/mol:	44.34
Dipole, Da:	1.53
IP(EA), eV:	-8.62(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzothiazol-2-ylsulfanyl)propan-2-amine

Drug info:

PubChemData

Smile

CC(C)NSC1=NC2=CC=CC=C2S1

DOS

IR

Vibrations