Geometry & MOs

Info

ID:	355682
PubChem CID:	127289663
Reduced:	O3N4C19H34 (1)
Stoich.:	A3B4C19D34 (1)
Weight, g/mol:	398.231791
ΔH_f, kcal/mol:	-145.65
Dipole, Da:	7.11
IP(EA), eV:	-8.72(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperidin-4-yl]-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)C(=O)CN2CCC(CC2)N(C)C(=O)C3CCOCC3

DOS

IR

Vibrations