Geometry & MOs

Info

ID:	216020
PubChem CID:	85085590
Reduced:	O3C12H22 (1)
Stoich.:	A3B12C22 (1)
Weight, g/mol:	214.156895
ΔH_f, kcal/mol:	-180.14
Dipole, Da:	1.81
IP(EA), eV:	-10.19(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-hydroxy-3-methylbutyl)-3-propan-2-yloxolan-2-one

Drug info:

PubChemData

Smile

CCCCC1CCCC(C1O)OC(=O)C

DOS

IR

Vibrations