Geometry & MOs

Info

ID:	449548
PubChem CID:	135299490
Reduced:	O6C13H26 (1)
Stoich.:	A6B13C26 (1)
Weight, g/mol:	352.209718
ΔH_f, kcal/mol:	-318.05
Dipole, Da:	2.26
IP(EA), eV:	-9.83(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-[1-(1,3-dihydroxypropan-2-yloxy)-3-hydroxypropan-2-yl]oxy-4-hydroxyoctan-2-yl] acetate

Drug info:

PubChemData

Smile

CCC(CC(CC(C)OC(=O)C)O)OC(CO)CO

DOS

IR

Vibrations