Geometry & MOs

Info

ID:	196366
PubChem CID:	78815401
Reduced:	NSC15H17 (1)
Stoich.:	ABC15D17 (1)
Weight, g/mol:	353.156184
ΔH_f, kcal/mol:	33.98
Dipole, Da:	1.94
IP(EA), eV:	-8.14(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-[benzyl(ethyl)amino]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)SCCC2=CC=CC=N2)C

DOS

IR

Vibrations