Geometry & MOs

Info

ID:	13563
PubChem CID:	301154
Reduced:	OC5H6 (2)
Stoich.:	AB5C6 (2)
Weight, g/mol:	164.08373
ΔH_f, kcal/mol:	-62.56
Dipole, Da:	2.81
IP(EA), eV:	-10.12(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tricyclo[4.2.2.01,6]decane-2,7-dione

Drug info:

PubChemData

Smile

C1CC(=O)C23CCC2(C1)C(=O)C3

DOS

IR

Vibrations