Geometry & MOs

Info

ID:	442052
PubChem CID:	135248552
Reduced:	OC8H9 (2)
Stoich.:	AB8C9 (2)
Weight, g/mol:	688.29506
ΔH_f, kcal/mol:	-53.84
Dipole, Da:	0.78
IP(EA), eV:	-8.6(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[8-[4,6-bis(2,4,6-trimethylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]benzimidazolo[1,2-a]benzimidazole

Drug info:

PubChemData

Smile

CCC(C)(C)C1=CC2=CC3=C(C=C2C=C1)OCO3

DOS

IR

Vibrations