Geometry & MOs

Info

ID:	354732
PubChem CID:	127287431
Reduced:	O3N5C20H35 (1)
Stoich.:	A3B5C20D35 (1)
Weight, g/mol:	282.205576
ΔH_f, kcal/mol:	-161.35
Dipole, Da:	4.82
IP(EA), eV:	-9.05(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-acetylpiperidin-4-yl)methyl]-4-methylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC(CC1)CNC(=O)N2CCN(CC2)CC(=O)N3CCCCC3

DOS

IR

Vibrations