Geometry & MOs

Info

ID:	433347
PubChem CID:	135173484
Reduced:	BrO4N7C33H36 (1)
Stoich.:	AB4C7D33E36 (1)
Weight, g/mol:	383.92769
ΔH_f, kcal/mol:	-34.18
Dipole, Da:	5.43
IP(EA), eV:	-8.13(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-iodo-5-methyl-1,1,3-trioxo-1,2-thiazol-2-yl)piperidine-2,6-dione

Drug info:

PubChemData

Smile

CNC(=O)CN1C(=O)C2=C(C1=O)C(=CC=C2)OCCCCN3CCN(CC3)C4=CC=C(C=C4)N=C/C(=C(/C5=CC=NC=C5)\N)/Br

DOS

IR

Vibrations