Geometry & MOs

Info

ID:	130352
PubChem CID:	51075685
Reduced:	SO3N4C15H18 (1)
Stoich.:	AB3C4D15E18 (1)
Weight, g/mol:	304.124549
ΔH_f, kcal/mol:	-96.92
Dipole, Da:	1.96
IP(EA), eV:	-9.25(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-methyl-2,3-dihydro-1-benzothiophene-2-carbonyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)CCN2C=NC3=C(C2=O)C=CS3)C(=O)N

DOS

IR

Vibrations