Geometry & MOs

Info

ID:

378203

PubChem CID:

134224279

Reduced:

FPN3O9C22H27 (1)

Stoich.:

ABC3D9E22F27 (1)

Weight, g/mol:

545.157459

ΔHf, kcal/mol:

-455.37

Dipole, Da:

8.0

IP(EA), eV:

 -9.68(-0.55)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-methoxyethyl (2S)-2-[[[(2S,3S,4R,5S)-4-fluoro-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-phenoxyphosphoryl]amino]propanoate

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1=O)[C@@H]2[C@@H]([C@H]([C@@H](O2)COP(=O)(N[C@@H](C)C(=O)OCC=C)OC3=CC=CC=C3)O)F

DOS

IR

Vibrations