Geometry & MOs

Info

ID:	13567
PubChem CID:	301163
Reduced:	OC7H9 (2)
Stoich.:	AB7C9 (2)
Weight, g/mol:	218.13068
ΔH_f, kcal/mol:	-96.47
Dipole, Da:	4.84
IP(EA), eV:	-10.02(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tetracyclo[6.6.0.02,6.010,14]tetradecane-5,11-dione

Drug info:

PubChemData

Smile

C1CC(=O)C2C1C3C4CCC(=O)C4CC3C2

DOS

IR

Vibrations