Geometry & MOs

Info

ID:	9579
PubChem CID:	91151
Reduced:	O2C15H26 (1)
Stoich.:	A2B15C26 (1)
Weight, g/mol:	238.19328
ΔH_f, kcal/mol:	-146.5
Dipole, Da:	2.34
IP(EA), eV:	-10.24(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5,5,8a-trimethyl-1,2,3,4,4a,6,7,8-octahydronaphthalen-2-yl) acetate

Drug info:

PubChemData

Smile

CC(=O)OC1CCC2C(CCCC2(C1)C)(C)C

DOS

IR

Vibrations