Geometry & MOs

Info

ID:	218213
PubChem CID:	85089035
Reduced:	O2F3N3C23H32 (1)
Stoich.:	A2B3C3D23E32 (1)
Weight, g/mol:	439.156577
ΔH_f, kcal/mol:	-241.71
Dipole, Da:	4.28
IP(EA), eV:	-8.75(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-benzyl-1-(2,2-dimethylpropyl)-3-(1,1-dioxo-4H-1lambda6,2,4-benzothiadiazin-3-yl)pyrrolidine-2,4-dione

Drug info:

PubChemData

Smile

CC(C)C1(CCC(C1)NC2CCOCC2)C(=O)N3CCC4=C(N3)C=CC(=C4)C(F)(F)F

DOS

IR

Vibrations