Geometry & MOs

Info

ID:	396420
PubChem CID:	135028394
Reduced:	OH9C15 (2)
Stoich.:	AB9C15 (2)
Weight, g/mol:	661.85508
ΔH_f, kcal/mol:	125.44
Dipole, Da:	3.01
IP(EA), eV:	-8.23(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,10,15-tribromo-4,9,14-triphenyl-3,8,13-trioxatetracyclo[10.3.0.02,6.07,11]pentadeca-1,4,6,9,11,14-hexaene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C#CC2=C(C3=CC4=C(C=C3C=C2)C(=C(C=C4)C#CC5=CC=CC=C5)O)O

DOS

IR

Vibrations