Geometry & MOs

Info

ID:	224284
PubChem CID:	85341091
Reduced:	O2C8H11 (2)
Stoich.:	A2B8C11 (2)
Weight, g/mol:	280.203845
ΔH_f, kcal/mol:	-157.97
Dipole, Da:	3.19
IP(EA), eV:	-9.54(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)methyl acetate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C=CC1=CC=CC=C1C(OC)OC

DOS

IR

Vibrations