Geometry & MOs

Info

ID:	385683
PubChem CID:	134979727
Reduced:	CuO2C10H17 (1)
Stoich.:	AB2C10D17 (1)
Weight, g/mol:	264.20893
ΔH_f, kcal/mol:	42.74
Dipole, Da:	3.34
IP(EA), eV:	-8.37(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,4aR,9aR)-1,1,4a,7-tetramethyl-3,4,5,8,9,9a-hexahydro-2H-benzo[7]annulen-2-yl] acetate

Drug info:

PubChemData

Smile

CCCCC=[C-]CCOC(=O)C.[Cu+]

DOS

IR

Vibrations