Geometry & MOs

Info

ID:

395060

PubChem CID:

135024535

Reduced:

SN2O6C28H34 (1)

Stoich.:

AB2C6D28E34 (1)

Weight, g/mol:

510.158906

ΔHf, kcal/mol:

-125.06

Dipole, Da:

8.51

IP(EA), eV:

 -9.65(-1.66)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(2S,3S,4S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2,4-dioxopyrimidin-1-yl)-2-(hydroxymethyl)-4-methyloxolan-2-yl] 3-chlorobenzoate

Drug info:

PubChemData

Smile

C1C[C@H]2[C@@H](C[C@H]3[C@]2(CCCN(C1)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-])C(C=CC3)O)OCC5=CC=CC=C5

DOS

IR

Vibrations