Geometry & MOs

Info

ID:	355689
PubChem CID:	127289670
Reduced:	O3N4C21H32 (1)
Stoich.:	A3B4C21D32 (1)
Weight, g/mol:	389.24269
ΔH_f, kcal/mol:	-100.05
Dipole, Da:	4.21
IP(EA), eV:	-8.51(0.01)
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]-2-(2-oxopyridin-1-yl)acetamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)C(=O)CN2CCC(CC2)N(C)C(=O)COC3=CC=CC=C3

DOS

IR

Vibrations