Geometry & MOs

Info

ID:	70491
PubChem CID:	48413424
Reduced:	OSN2C8H12 (2)
Stoich.:	ABC2D8E12 (2)
Weight, g/mol:	410.144633
ΔH_f, kcal/mol:	-45.43
Dipole, Da:	3.92
IP(EA), eV:	-8.51(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1,3-benzothiazol-2-yl)piperidin-4-yl]-2,6-dimethylmorpholine-4-sulfonamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)NC1CCN(CC1)C2=NC3=CC=CC=C3S2

DOS

IR

Vibrations