Geometry & MOs

Info

ID:	135702
PubChem CID:	51920014
Reduced:	N2O6C25H30 (1)
Stoich.:	A2B6C25D30 (1)
Weight, g/mol:	422.147786
ΔH_f, kcal/mol:	-217.91
Dipole, Da:	7.01
IP(EA), eV:	-8.8(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-acetamidophenyl)-2-oxoethyl] (2R)-2-(1,3-dioxoisoindol-2-yl)-3-methylbutanoate

Drug info:

PubChemData

Smile

CC1=CC(=C(N1[C@@H](C)COC)C)C(=O)COC(=O)[C@H](C(C)C)N2C(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations