Geometry & MOs

Info

ID:	19371
PubChem CID:	562769
Reduced:	O2H8C9 (1)
Stoich.:	A2B8C9 (1)
Weight, g/mol:	148.052429
ΔH_f, kcal/mol:	-42.97
Dipole, Da:	4.81
IP(EA), eV:	-10.02(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bicyclo[3.3.1]nona-3,7-diene-2,9-dione

Drug info:

PubChemData

Smile

C1C=CC2C(=O)C=CC1C2=O

DOS

IR

Vibrations