Geometry & MOs

Info

ID:	363563
PubChem CID:	127311642
Reduced:	N3O4C21H31 (1)
Stoich.:	A3B4C21D31 (1)
Weight, g/mol:	388.247441
ΔH_f, kcal/mol:	-156.89
Dipole, Da:	6.51
IP(EA), eV:	-9.25(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2-methoxyacetyl)piperidin-4-yl]-4-[(4-methylpiperazin-1-yl)methyl]benzamide

Drug info:

PubChemData

Smile

COCC(=O)N1CCC(CC1)NC(=O)C(C2=CC=CC=C2)N3CCC(CC3)O

DOS

IR

Vibrations