Geometry & MOs

Info

ID:	380702
PubChem CID:	134971229
Reduced:	IO3C15H17 (1)
Stoich.:	AB3C15D17 (1)
Weight, g/mol:	437.187209
ΔH_f, kcal/mol:	-109.4
Dipole, Da:	5.91
IP(EA), eV:	-9.66(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R)-2-(3-methyl-1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(2-methyl-5-oxo-3-pyrrolidin-1-ylfuran-2-yl)ethyl] (E)-4-methylpent-2-enoate

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)OC1=CC2=C(C=C1)C(=O)C(CC2)I

DOS

IR

Vibrations