Geometry & MOs

Info

ID:	315735
PubChem CID:	126628634
Reduced:	NC9H15 (1)
Stoich.:	AB9C15 (1)
Weight, g/mol:	502.330777
ΔH_f, kcal/mol:	22.32
Dipole, Da:	2.41
IP(EA), eV:	-9.17(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzylpiperidin-4-yl)-3-[1-[(2E,4E)-5-(methylamino)hexa-2,4-dien-2-yl]piperidin-4-yl]oxybenzamide

Drug info:

PubChemData

Smile

CC/C=C\C(=NC=C)CC

DOS

IR

Vibrations