Geometry & MOs

Info

ID:	446379
PubChem CID:	135274556
Reduced:	O2C7H14 (1)
Stoich.:	A2B7C14 (1)
Weight, g/mol:	218.13068
ΔH_f, kcal/mol:	-77.05
Dipole, Da:	2.57
IP(EA), eV:	-9.89(1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-ethyl-2,6-dimethyltricyclo[5.2.1.02,6]dec-8-ene-3,5-dione

Drug info:

PubChemData

Smile

CCOCC1(C(O1)C)C

DOS

IR

Vibrations