Geometry & MOs

Info

ID:

298849

PubChem CID:

117661736

Reduced:

SN4H26C42 (1)

Stoich.:

AB4C26D42 (1)

Weight, g/mol:

489.142478

ΔHf, kcal/mol:

245.6

Dipole, Da:

1.6

IP(EA), eV:

 -8.07(-1.43)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(2R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4-fluoro-3-hydroxy-4-methyloxolan-2-yl]methoxy-N-[[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methyl]phosphonamidic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)C4=CC=C(C5=NSN=C45)C6=CC7=C(C=C6)N(C8=CC=CC=C87)C9=CC=CC=C9)C1=CC=CC=C12

DOS

IR

Vibrations