Geometry & MOs

Info

ID:	356766
PubChem CID:	127292306
Reduced:	FN2O3C21H23 (1)
Stoich.:	AB2C3D21E23 (1)
Weight, g/mol:	337.143784
ΔH_f, kcal/mol:	-139.15
Dipole, Da:	4.52
IP(EA), eV:	-9.1(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2CN(C1)C(=O)NCCC3=CC(=CC4=C3OCOC4)F

DOS

IR

Vibrations