Geometry & MOs

Info

ID:	380340
PubChem CID:	134970754
Reduced:	OC10H15 (2)
Stoich.:	AB10C15 (2)
Weight, g/mol:	318.219495
ΔH_f, kcal/mol:	-112.61
Dipole, Da:	6.88
IP(EA), eV:	-9.12(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-3-[2-[(1S)-1,2,5,5-tetramethyl-2,3,4,6,7,8-hexahydronaphthalen-1-yl]ethyl]-2H-furan-5-one

Drug info:

PubChemData

Smile

CC1CCC2=C([C@@]1(C)CCC3=CC(=O)OC3)CCCC2(C)C

DOS

IR

Vibrations