Geometry & MOs

Info

ID:

410701

PubChem CID:

135083502

Reduced:

AuFeOPH26C29 (1)

Stoich.:

ABCDE26F29 (1)

Weight, g/mol:

305.085914

ΔHf, kcal/mol:

169.85

Dipole, Da:

6.56

IP(EA), eV:

 -6.86(-0.84)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-amino-4-hydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1H-pyrimidin-6-one

Drug info:

PubChemData

Smile

CO[C]1[CH][CH][CH][CH]1.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[CH]1[CH][CH][C-][CH]1.[Fe].[Au+]

DOS

IR

Vibrations