Geometry & MOs

Info

ID:	52493
PubChem CID:	12015372
Reduced:	SN2O6H12C19 (1)
Stoich.:	AB2C6D12E19 (1)
Weight, g/mol:	394.062343
ΔH_f, kcal/mol:	-130.82
Dipole, Da:	7.93
IP(EA), eV:	-9.82(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(5,5-dioxodibenzothiophen-2-yl)-4-methyl-4a,8a-dihydro-2H-pyrano[3,4-d]pyridazine-1,5-dione

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(S2(=O)=O)C=CC(=C3)C4=CC5C(C(=O)NNC5=O)C(=O)O4

DOS

IR

Vibrations