Geometry & MOs

Info

ID:	190311
PubChem CID:	77984251
Reduced:	ClSN4O4C27H29 (1)
Stoich.:	ABC4D4E27F29 (1)
Weight, g/mol:	321.147727
ΔH_f, kcal/mol:	-75.18
Dipole, Da:	7.2
IP(EA), eV:	-8.58(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-3-[1-(pyridin-2-ylamino)prop-1-en-2-yl]pyrrolidine-2,5-dione

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)N2CC(CC2=O)CNC(=O)C3=CC=C(S3)Cl)N4C=CC=C(C4=O)OCCNC5CC5

DOS

IR

Vibrations