Geometry & MOs

Info

ID:	329899
PubChem CID:	127246766
Reduced:	ON4C17H26 (1)
Stoich.:	AB4C17D26 (1)
Weight, g/mol:	353.173942
ΔH_f, kcal/mol:	-20.54
Dipole, Da:	5.23
IP(EA), eV:	-8.26(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(C)C1=NC=CC(=C1)C2CCCN2CC(=O)N3CCCC3

DOS

IR

Vibrations