Geometry & MOs

Info

ID:	24766
PubChem CID:	613198
Reduced:	H16C17 (1)
Stoich.:	A16B17 (1)
Weight, g/mol:	220.125201
ΔH_f, kcal/mol:	120.03
Dipole, Da:	2.13
IP(EA), eV:	-7.63(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tricyclo[9.2.2.24,7]heptadeca-1(14),2,4,6,11(15),12,16-heptaene

Drug info:

PubChemData

Smile

C1CC2=CC=C(C=C2)C=CC3=CC=C(C1)C=C3

DOS

IR

Vibrations