Geometry & MOs

Info

ID:

390037

PubChem CID:

134996737

Reduced:

NO20C27H47 (1)

Stoich.:

AB20C27D47 (1)

Weight, g/mol:

439.239014

ΔHf, kcal/mol:

-904.88

Dipole, Da:

8.36

IP(EA), eV:

-10.06(0.05)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

methyl (2S)-3-[benzyl(hydroxy)amino]-2-[tert-butyl(dimethyl)silyl]oxy-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]propanoate

Drug info:

PubChemData

Smile

CC1C(C(C(C(O1)OC2C(C(C(OC2OC3C(C(OC(C3O)CO)OC)NC(=O)C)CO)O)OC4C(C(C(C(O4)CO)O)O)O)O)O)O

DOS

IR

Vibrations