Geometry & MOs

Info

ID:	152900
PubChem CID:	56311988
Reduced:	FO2N3C20H22 (1)
Stoich.:	AB2C3D20E22 (1)
Weight, g/mol:	456.219512
ΔH_f, kcal/mol:	-64.29
Dipole, Da:	1.87
IP(EA), eV:	-8.94(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-oxo-2-[4-(thiophene-2-carbonylamino)anilino]ethyl]-N-pentan-2-ylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)CN(CC1=CC=C(C=C1)F)CC2=NC3=CC=CC=C3N2C

DOS

IR

Vibrations