Geometry & MOs

Info

ID:	347103
PubChem CID:	127271607
Reduced:	FN2O4C18H23 (1)
Stoich.:	AB2C4D18E23 (1)
Weight, g/mol:	367.154349
ΔH_f, kcal/mol:	-177.17
Dipole, Da:	2.84
IP(EA), eV:	-9.27(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC1N(CC2CCOC2)C(=O)NCC3=CC(=CC4=C3OCOC4)F

DOS

IR

Vibrations