Geometry & MOs

Info

ID:	152524
PubChem CID:	56311476
Reduced:	SO2N4H22C24 (1)
Stoich.:	AB2C4D22E24 (1)
Weight, g/mol:	496.160283
ΔH_f, kcal/mol:	46.42
Dipole, Da:	4.48
IP(EA), eV:	-8.32(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-oxo-2-[4-(thiophene-2-carbonylamino)anilino]ethyl]-N-(2-thiophen-2-ylethyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C=CCN(CC1=CC(=CC=C1)C#N)CC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3

DOS

IR

Vibrations