Geometry & MOs

Info

ID:	18305
PubChem CID:	539511
Reduced:	O3C19H32 (1)
Stoich.:	A3B19C32 (1)
Weight, g/mol:	308.235145
ΔH_f, kcal/mol:	-115.67
Dipole, Da:	2.69
IP(EA), eV:	-9.18(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6,8,9-trimethyl-4-pentyl-3-oxabicyclo[3.3.1]non-6-en-1-yl)methyl acetate

Drug info:

PubChemData

Smile

CCCCCC1C2C(C(CO1)(C(C=C2C)C)COC(=O)C)C

DOS

IR

Vibrations