Geometry & MOs

Info

ID:	220712
PubChem CID:	85230651
Reduced:	O3C12H22 (1)
Stoich.:	A3B12C22 (1)
Weight, g/mol:	214.156895
ΔH_f, kcal/mol:	-152.02
Dipole, Da:	3.46
IP(EA), eV:	-9.84(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-5-methyl-3-(5-methylhexyl)oxolan-2-one

Drug info:

PubChemData

Smile

CCCCC1(OCCO1)CCC=CCO

DOS

IR

Vibrations