Geometry & MOs

Info

ID:	346981
PubChem CID:	127271485
Reduced:	FN4O4C18H25 (1)
Stoich.:	AB4C4D18E25 (1)
Weight, g/mol:	372.252526
ΔH_f, kcal/mol:	-199.37
Dipole, Da:	5.18
IP(EA), eV:	-8.73(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzyl-N-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)C(=O)CCNC(=O)NCC2=CC(=CC3=C2OCOC3)F

DOS

IR

Vibrations