Geometry & MOs

Info

ID:

323988

PubChem CID:

126676720

Reduced:

F3N9C21H22 (1)

Stoich.:

A3B9C21D22 (1)

Weight, g/mol:

515.146895

ΔHf, kcal/mol:

1.07

Dipole, Da:

5.05

IP(EA), eV:

 -8.8(-0.96)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

propan-2-yl (2S)-2-[[[(2R,3R,4S,5R)-5-(2,4-dioxopyrimidin-1-yl)-4-fluoro-3-hydroxyoxolan-2-yl]methoxy-phenoxyphosphoryl]amino]propanoate

Drug info:

PubChemData

Smile

C1CN(CC(N1)C(F)(F)F)C2=CC=CC(=C2)CN3C=C(C=N3)CC4=CC(=NC5=NNN=C45)N

DOS

IR

Vibrations