Geometry & MOs

Info

ID:	156829
PubChem CID:	56394584
Reduced:	N3O4C23H29 (1)
Stoich.:	A3B4C23D29 (1)
Weight, g/mol:	370.144806
ΔH_f, kcal/mol:	-116.87
Dipole, Da:	3.09
IP(EA), eV:	-8.5(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(3-chlorophenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]prop-2-enamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)N2CCC(CC2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CO4

DOS

IR

Vibrations