Geometry & MOs

Info

ID:	362864
PubChem CID:	127309693
Reduced:	SO3N4C18H28 (1)
Stoich.:	AB3C4D18E28 (1)
Weight, g/mol:	389.231456
ΔH_f, kcal/mol:	-101.03
Dipole, Da:	6.4
IP(EA), eV:	-8.96(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

COCCN1CCCC1CNC(=O)N2CCN(CC2)C(=O)C3=CC=CS3

DOS

IR

Vibrations