Geometry & MOs

Info

ID:	198734
PubChem CID:	79142869
Reduced:	SN2C12H14 (1)
Stoich.:	AB2C12D14 (1)
Weight, g/mol:	289.088498
ΔH_f, kcal/mol:	46.83
Dipole, Da:	2.74
IP(EA), eV:	-9.11(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-[(6-methyl-1,3-benzothiazol-2-yl)amino]piperidine-2,6-dione

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N=C(S2)CC3CNC3

DOS

IR

Vibrations