Geometry & MOs

Info

ID:

381522

PubChem CID:

134972285

Reduced:

NS2O6C21H23 (1)

Stoich.:

AB2C6D21E23 (1)

Weight, g/mol:

702.253707

ΔHf, kcal/mol:

-207.55

Dipole, Da:

10.07

IP(EA), eV:

 -8.73(-0.62)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl (2R,3S,4R,5S,6R)-3,4-bis[[tert-butyl(dimethyl)silyl]oxy]-6-[(4-methoxyphenyl)methoxymethyl]-5-(trifluoromethylsulfonyloxy)oxane-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1CC2=CC3=C(COS(=O)C3)C=C2CN1S(=O)(=O)C4=CC=C(C=C4)C

DOS

IR

Vibrations