Geometry & MOs

Info

ID:	264316
PubChem CID:	103453861
Reduced:	O4C13H16 (1)
Stoich.:	A4B13C16 (1)
Weight, g/mol:	200.141244
ΔH_f, kcal/mol:	-143.92
Dipole, Da:	3.58
IP(EA), eV:	-9.06(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-1-(oxolan-2-yl)heptan-3-one

Drug info:

PubChemData

Smile

CCCC(C(=O)C1=CC2=C(C=C1)OCCO2)O

DOS

IR

Vibrations