Geometry & MOs

Info

ID:	347964
PubChem CID:	127273026
Reduced:	O2F3N4C15H25 (1)
Stoich.:	A2B3C4D15E25 (1)
Weight, g/mol:	296.221226
ΔH_f, kcal/mol:	-259.12
Dipole, Da:	6.69
IP(EA), eV:	-8.63(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-methylpiperazin-1-yl)propyl]-2-(2-oxopiperidin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC(CNC(=O)C1CC(=O)N(C1)CC(F)(F)F)N2CCN(CC2)C

DOS

IR

Vibrations