Geometry & MOs

Info

ID:	16051
PubChem CID:	458717
Reduced:	OH7C8 (2)
Stoich.:	AB7C8 (2)
Weight, g/mol:	238.09938
ΔH_f, kcal/mol:	-16.03
Dipole, Da:	1.97
IP(EA), eV:	-9.53(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenyltricyclo[5.2.1.02,6]dec-8-ene-3,5-dione

Drug info:

PubChemData

Smile

C1C2C=CC1C3C2C(=O)C(C3=O)C4=CC=CC=C4

DOS

IR

Vibrations