Geometry & MOs

Info

ID:	343758
PubChem CID:	127266934
Reduced:	FOSN4C14H17 (1)
Stoich.:	ABCD4E14F17 (1)
Weight, g/mol:	332.076553
ΔH_f, kcal/mol:	-27.7
Dipole, Da:	3.52
IP(EA), eV:	-8.53(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzothiazol-2-yl)-2-[methyl(1,2-thiazol-5-ylmethyl)amino]propanamide

Drug info:

PubChemData

Smile

CN(CCC(=O)NC1=C(C=CC(=C1)N)F)CC2=CC=NS2

DOS

IR

Vibrations