Geometry & MOs

Info

ID:

168423

PubChem CID:

74965677

Reduced:

PF3N4O11C23H30 (1)

Stoich.:

AB3C4D11E23F30 (1)

Weight, g/mol:

670.186294

ΔHf, kcal/mol:

-660.94

Dipole, Da:

9.52

IP(EA), eV:

 -9.68(-0.49)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-methoxypropyl 2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-phenoxyphosphoryl]amino]propanoate;2,2,2-trifluoroacetic acid

Drug info:

PubChemData

Smile

CCOC(=O)C(C)NP(=O)(OCC1C(C(C(O1)N2C=CC(=NC2=O)N)(C)O)O)OC3=CC=CC=C3.C(=O)(C(F)(F)F)O

DOS

IR

Vibrations