Geometry & MOs

Info

ID:	6051
PubChem CID:	14351
Reduced:	OH12C15 (1)
Stoich.:	AB12C15 (1)
Weight, g/mol:	208.088815
ΔH_f, kcal/mol:	1.61
Dipole, Da:	3.0
IP(EA), eV:	-9.24(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tricyclo[9.4.0.02,7]pentadeca-1(15),2,4,6,11,13-hexaen-9-one

Drug info:

PubChemData

Smile

C1C(=O)CC2=CC=CC=C2C3=CC=CC=C31

DOS

IR

Vibrations