Geometry & MOs

Info

ID:	441469
PubChem CID:	135235168
Reduced:	NC8H11 (2)
Stoich.:	AB8C11 (2)
Weight, g/mol:	464.190714
ΔH_f, kcal/mol:	12.37
Dipole, Da:	1.06
IP(EA), eV:	-7.82(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-4-[1-[3-[(Z)-4-methoxy-1,4-dioxo-1-[1-(2-oxopyrrolidin-1-yl)ethylamino]but-2-en-2-yl]-2-oxopyrrolidin-1-yl]ethylamino]-4-oxobut-2-enoic acid

Drug info:

PubChemData

Smile

CC(C)NC1=C2C(=C(C=C1)C(C)(C)C)C=CC=N2

DOS

IR

Vibrations