Geometry & MOs

Info

ID:	155011
PubChem CID:	56314577
Reduced:	SO2N4H14C18 (1)
Stoich.:	AB2C4D14E18 (1)
Weight, g/mol:	435.076803
ΔH_f, kcal/mol:	59.68
Dipole, Da:	5.23
IP(EA), eV:	-9.17(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-[(E)-3-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)prop-2-enoyl]piperazin-1-yl]-2-oxoethyl]pyrrolidine-2,5-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C=C(C=N2)C3=NC(=CS3)C(=O)NCC4=COC=C4

DOS

IR

Vibrations