Geometry & MOs

Info

ID:	218806
PubChem CID:	85090003
Reduced:	O3C6H8 (4)
Stoich.:	A3B6C8 (4)
Weight, g/mol:	512.215866
ΔH_f, kcal/mol:	-504.92
Dipole, Da:	2.1
IP(EA), eV:	-8.74(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[4-benzyl-2-(2-ethoxy-2-oxoethyl)-2-hydroxy-5-oxo-4-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]propanoate

Drug info:

PubChemData

Smile

CC(=O)OCC1C(C(C(C(O1)OCCOCC2=CC=C(C=C2)OC)OC(=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations