Geometry & MOs

Info

ID:	406463
PubChem CID:	135077675
Reduced:	SO7C27H30 (1)
Stoich.:	AB7C27D30 (1)
Weight, g/mol:	498.171224
ΔH_f, kcal/mol:	-207.06
Dipole, Da:	4.85
IP(EA), eV:	-9.38(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3R,4R)-5-oxo-2,3,4-tris(phenylmethoxy)pentyl] methanesulfonate

Drug info:

PubChemData

Smile

CS(=O)(=O)OC[C@@H]([C@@H]([C@H](C=O)OCC1=CC=CC=C1)OCC2=CC=CC=C2)OCC3=CC=CC=C3

DOS

IR

Vibrations