Geometry & MOs

Info

ID:	73540
PubChem CID:	48418075
Reduced:	SO3N4C20H28 (1)
Stoich.:	AB3C4D20E28 (1)
Weight, g/mol:	379.135448
ΔH_f, kcal/mol:	-117.73
Dipole, Da:	3.47
IP(EA), eV:	-8.47(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1,3-benzothiazol-2-yl)piperidin-4-yl]-2,3-dihydro-1-benzofuran-5-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)NC(C(C)C)C(=O)NC1CCN(CC1)C2=NC3=CC=CC=C3S2

DOS

IR

Vibrations