Geometry & MOs

Info

ID:	370464
PubChem CID:	127338977
Reduced:	FSN3O4C17H22 (1)
Stoich.:	ABC3D4E17F22 (1)
Weight, g/mol:	304.142307
ΔH_f, kcal/mol:	-192.24
Dipole, Da:	6.01
IP(EA), eV:	-9.59(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1-methyl-2-oxopyrrolidin-3-yl)propanamide

Drug info:

PubChemData

Smile

CN1CCC(C1=O)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations