Geometry & MOs

Info

ID:	64644
PubChem CID:	29203746
Reduced:	NO5H21C26 (1)
Stoich.:	AB5C21D26 (1)
Weight, g/mol:	385.152537
ΔH_f, kcal/mol:	-131.42
Dipole, Da:	8.14
IP(EA), eV:	-8.62(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methoxycarbonyl-5-methylfuran-2-yl)methyl (3S)-1-(4-ethylphenyl)-5-oxopyrrolidine-3-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)OCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4

DOS

IR

Vibrations