Geometry & MOs

Info

ID:	313449
PubChem CID:	126614796
Reduced:	O10C49H96 (1)
Stoich.:	A10B49C96 (1)
Weight, g/mol:	118.062994
ΔH_f, kcal/mol:	-657.96
Dipole, Da:	4.16
IP(EA), eV:	-9.44(1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,5S)-oxane-3,5-diol

Drug info:

PubChemData

Smile

CCCCCCCCCCCC(=O)OC(C)(C)CCOC(C)(C)CC(C1C(C(CO1)C(C)(C)OCCC(C)(C)O)C(C)(C)OCCC(C)(C)O)C(C)(C)OCC(C)(C)O

DOS

IR

Vibrations