Geometry & MOs

Info

ID:	353728
PubChem CID:	127285305
Reduced:	O2N5C20H31 (1)
Stoich.:	A2B5C20D31 (1)
Weight, g/mol:	361.247775
ΔH_f, kcal/mol:	-44.79
Dipole, Da:	3.99
IP(EA), eV:	-8.62(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-ethylpiperidin-4-yl)-2-[4-(4-methoxypyridin-2-yl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

COC1=CC(=NC=C1)N2CCN(CC2)CC(=O)NC3CCN(CC3)C4CC4

DOS

IR

Vibrations