Geometry & MOs

Info

ID:

318670

PubChem CID:

126652675

Reduced:

NO11C16H27 (1)

Stoich.:

AB11C16D27 (1)

Weight, g/mol:

425.145083

ΔHf, kcal/mol:

-485.96

Dipole, Da:

7.52

IP(EA), eV:

 -9.78(0.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[1-[(1R)-1-[(3R,5R,6S)-5-acetamido-3-hydroxy-2-(hydroxymethyl)-6-methyloxan-4-yl]oxy-2-phosphanylethoxy]-2-methoxy-3-oxopropyl] formate

Drug info:

PubChemData

Smile

C[C@H]1[C@H](C([C@H](C(O1)CO)O)O[C@H]2[C@H](C([C@@H](C(O2)OC=O)OC)O)O)NC(=O)C

DOS

IR

Vibrations