Geometry & MOs

Info

ID:	380826
PubChem CID:	134971395
Reduced:	SO6C35H36 (1)
Stoich.:	AB6C35D36 (1)
Weight, g/mol:	542.212695
ΔH_f, kcal/mol:	-155.65
Dipole, Da:	3.97
IP(EA), eV:	-8.41(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,6S)-3,4,5-tris(phenylmethoxy)-6-phenylsulfanyloxan-2-yl]methanol

Drug info:

PubChemData

Smile

CC(=O)OCC1[C@H](C(C([C@@H](O1)SC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5

DOS

IR

Vibrations