Geometry & MOs

Info

ID:	229545
PubChem CID:	87567985
Reduced:	NO4H9C12 (1)
Stoich.:	AB4C9D12 (1)
Weight, g/mol:	588.094883
ΔH_f, kcal/mol:	-71.29
Dipole, Da:	3.22
IP(EA), eV:	-9.27(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3Z)-3-[6-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-2,4-dioxopiperidin-3-ylidene]-1,1-dioxo-4H-1lambda6,2,4-benzothiadiazin-7-yl]methanesulfonamide

Drug info:

PubChemData

Smile

COC1=C(C(=O)C1=O)C2=CC(=CC=C2)C(=O)N

DOS

IR

Vibrations