Geometry & MOs

Info

ID:

17236

PubChem CID:

489585

Reduced:

PN5O11C32H58 (1)

Stoich.:

AB5C11D32E58 (1)

Weight, g/mol:

719.387045

ΔHf, kcal/mol:

-561.81

Dipole, Da:

8.75

IP(EA), eV:

 -9.96(-0.82)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione;[hydroxy-[(2R)-2-hydroxy-3-octadecoxypropoxy]phosphoryl]formic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCOC[C@H](COP(=O)(C(=O)O)O)O.CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)N=[N+]=[N-]

DOS

IR

Vibrations