Geometry & MOs

Info

ID:

378287

PubChem CID:

134224363

Reduced:

PN6O8C21H23 (1)

Stoich.:

AB6C8D21E23 (1)

Weight, g/mol:

577.204998

ΔHf, kcal/mol:

-258.99

Dipole, Da:

9.55

IP(EA), eV:

 -9.04(-0.32)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-methoxyethyl (2S)-2-[[[(2R,4R)-4-[2-amino-6-(cyclopropylamino)purin-9-yl]-1,3-dioxolan-2-yl]methoxy-phenoxyphosphoryl]amino]propanoate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)OCC#C)NP(=O)(OC[C@@H]1OC[C@@H](O1)N2C=NC3=C2NC(=NC3=O)N)OC4=CC=CC=C4

DOS

IR

Vibrations