Geometry & MOs

Info

ID:	3097
PubChem CID:	9152
Reduced:	H3C5 (4)
Stoich.:	A3B5 (4)
Weight, g/mol:	252.0939
ΔH_f, kcal/mol:	94.63
Dipole, Da:	0.11
IP(EA), eV:	-8.52(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(19),2(11),3,5,7,9,12,14,16(20),17-decaene

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC3=C2C4=CC=CC5=C4C3=CC=C5

DOS

IR

Vibrations