Geometry & MOs

Info

ID:	356855
PubChem CID:	127292447
Reduced:	FO3N4C20H29 (1)
Stoich.:	AB3C4D20E29 (1)
Weight, g/mol:	323.128134
ΔH_f, kcal/mol:	-153.2
Dipole, Da:	4.25
IP(EA), eV:	-8.46(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-2-methyl-3-oxopiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C2CCN(C2)C(=O)NCC3=CC(=CC4=C3OCOC4)F

DOS

IR

Vibrations