Geometry & MOs

Info

ID:	396419
PubChem CID:	135028392
Reduced:	OH9C15 (2)
Stoich.:	AB9C15 (2)
Weight, g/mol:	410.13068
ΔH_f, kcal/mol:	125.81
Dipole, Da:	0.35
IP(EA), eV:	-8.38(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-bis(2-phenylethynyl)anthracene-1,5-diol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C#CC2=CC3=CC4=CC(=C(C=C4C=C3C=C2O)C#CC5=CC=CC=C5)O

DOS

IR

Vibrations