Geometry & MOs

Info

ID:	440888
PubChem CID:	135232040
Reduced:	SN2O3H34C49 (1)
Stoich.:	AB2C3D34E49 (1)
Weight, g/mol:	658.229014
ΔH_f, kcal/mol:	110.87
Dipole, Da:	2.83
IP(EA), eV:	-8.18(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-bis(9,9-dimethylacridin-10-yl)-10,10-dioxothioxanthen-9-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC5=C(C=C4)S(=O)(=O)C6=C(C5=O)C=CC(=C6)C7=CC=C(C=C7)N(C8=CC=CC=C8)C9=CC=CC=C9

DOS

IR

Vibrations