Geometry & MOs

Info

ID:	381003
PubChem CID:	134971626
Reduced:	NO2C14H21 (1)
Stoich.:	AB2C14D21 (1)
Weight, g/mol:	341.129694
ΔH_f, kcal/mol:	-108.58
Dipole, Da:	3.8
IP(EA), eV:	-8.91(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[1-hydroxy-2-(3-methyl-1,1-dioxo-2,5-dihydrothiophen-2-yl)ethyl]-5-methyl-4-pyrrolidin-1-ylfuran-2-one

Drug info:

PubChemData

Smile

CC(C)NC(=O)C1=C(C(=CC=C1)C(C)(C)C)O

DOS

IR

Vibrations