Geometry & MOs

Info

ID:	218701
PubChem CID:	85089831
Reduced:	BrO5C25H37 (1)
Stoich.:	AB5C25D37 (1)
Weight, g/mol:	497.061233
ΔH_f, kcal/mol:	-248.99
Dipole, Da:	7.03
IP(EA), eV:	-8.65(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-chlorophenyl)methyl]-3-(1,1-dioxo-4H-1lambda6,2,4-benzothiadiazin-3-yl)-5-(4-fluorophenyl)pyrrolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1CC2=C3C1=CC4(CC(C(C4C3CCC2=CBr)(C)CC(C(C(C)(CO)O)O)O)O)C

DOS

IR

Vibrations