Geometry & MOs

Info

ID:	85071
PubChem CID:	49871583
Reduced:	ON2C10H14 (1)
Stoich.:	AB2C10D14 (1)
Weight, g/mol:	253.077265
ΔH_f, kcal/mol:	-35.34
Dipole, Da:	3.61
IP(EA), eV:	-8.66(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)ethyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC(C1=CC=CN1)N2CCCC2=O

DOS

IR

Vibrations