Geometry & MOs

Info

ID:	52492
PubChem CID:	12015371
Reduced:	NH4C5 (6)
Stoich.:	AB4C5 (6)
Weight, g/mol:	396.041607
ΔH_f, kcal/mol:	182.21
Dipole, Da:	5.16
IP(EA), eV:	-9.14(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(5,5-dioxodibenzothiophen-2-yl)-2,3,4a,8a-tetrahydropyrano[3,4-d]pyridazine-1,4,5-trione

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=CN2CC3=CC(=CC(=C3)CN4C=NC5=CC=CC=C54)CN6C=NC7=CC=CC=C76

DOS

IR

Vibrations