Geometry & MOs

Info

ID:	3098
PubChem CID:	9153
Reduced:	H3C5 (4)
Stoich.:	A3B5 (4)
Weight, g/mol:	252.0939
ΔH_f, kcal/mol:	89.8
Dipole, Da:	0.12
IP(EA), eV:	-8.7(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaene

Drug info:

PubChemData

Smile

C1=CC=C2C3=C4C(=CC=C3)C5=CC=CC=C5C4=CC2=C1

DOS

IR

Vibrations