Geometry & MOs

Info

ID:	329820
PubChem CID:	127246687
Reduced:	NC4H5 (4)
Stoich.:	AB4C5 (4)
Weight, g/mol:	339.158292
ΔH_f, kcal/mol:	59.94
Dipole, Da:	2.29
IP(EA), eV:	-8.53(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydro-1,4-benzodioxin-6-yl-[2-[2-(methylamino)pyridin-4-yl]pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CNC1=NC=CC(=C1)C2CCCN2CC3=CC=CC=N3

DOS

IR

Vibrations