Geometry & MOs

Info

ID:

405179

PubChem CID:

135072915

Reduced:

NF3O7H38C42 (1)

Stoich.:

AB3C7D38E42 (1)

Weight, g/mol:

590.324993

ΔHf, kcal/mol:

-283.58

Dipole, Da:

5.84

IP(EA), eV:

 -9.33(-0.83)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl-[[(2S,5R)-5-(2,4-ditert-butyl-3-methoxyphenyl)sulfanyloxolan-2-yl]methoxy]-diphenylsilane

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COCC2[C@@H](C(C([C@@H](O2)OC(=NC3=CC=CC=C3)C(F)(F)F)OC(=O)C4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6

DOS

IR

Vibrations