Geometry & MOs

Info

ID:	191056
PubChem CID:	78099879
Reduced:	O3C5H9 (2)
Stoich.:	A3B5C9 (2)
Weight, g/mol:	262.141638
ΔH_f, kcal/mol:	-287.73
Dipole, Da:	2.15
IP(EA), eV:	-10.26(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3,5-dihydroxy-6-methyloxan-2-yl)oxyhexanoic acid

Drug info:

PubChemData

Smile

CC1C(CC(C(O1)OC(C)CC(=O)O)O)O

DOS

IR

Vibrations