Geometry & MOs

Info

ID:	156826
PubChem CID:	56394569
Reduced:	NOC9H9 (3)
Stoich.:	ABC9D9 (3)
Weight, g/mol:	406.171499
ΔH_f, kcal/mol:	-45.89
Dipole, Da:	2.61
IP(EA), eV:	-8.71(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-methoxyphenyl)piperidin-4-yl]-3-(4-methylphenyl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)N2CCC(CC2)NC(=O)CN3C4=CC=CC=C4C(=O)C5=CC=CC=C53

DOS

IR

Vibrations