Geometry & MOs

Info

ID:	233185
PubChem CID:	87692919
Reduced:	OH28C48 (1)
Stoich.:	AB28C48 (1)
Weight, g/mol:	620.214016
ΔH_f, kcal/mol:	174.86
Dipole, Da:	1.57
IP(EA), eV:	-8.51(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,8-di(chrysen-6-yl)dibenzofuran

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC3=C2C4=C(C=C3)C(=CC=C4)C5=CC6=C(C=C5)OC7=C6C=C(C=C7)C8=CC=CC9=C8C=CC1=C9C2=CC=CC=C2C=C1

DOS

IR

Vibrations