Geometry & MOs

Info

ID:	3110
PubChem CID:	9167
Reduced:	H8C13 (2)
Stoich.:	A8B13 (2)
Weight, g/mol:	328.125201
ΔH_f, kcal/mol:	105.97
Dipole, Da:	0.03
IP(EA), eV:	-8.16(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hexacyclo[12.12.0.02,7.08,13.016,25.018,23]hexacosa-1(26),2,4,6,8,10,12,14,16,18,20,22,24-tridecaene

Drug info:

PubChemData

Smile

C1=CC=C2C=C3C=C4C5=CC=CC=C5C6=CC=CC=C6C4=CC3=CC2=C1

DOS

IR

Vibrations