Geometry & MOs

Info

ID:	33851
PubChem CID:	7888449
Reduced:	N3O5C21H21 (1)
Stoich.:	A3B5C21D21 (1)
Weight, g/mol:	417.142367
ΔH_f, kcal/mol:	-145.88
Dipole, Da:	4.74
IP(EA), eV:	-8.85(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl] (3S)-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxylate

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)NC(=O)CN2C(=O)C(=O)N(C2=O)C3=CC=C(C=C3)OC

DOS

IR

Vibrations