Geometry & MOs

Info

ID:

169763

PubChem CID:

75144657

Reduced:

SP3N7O19C30H38 (1)

Stoich.:

AB3C7D19E30F38 (1)

Weight, g/mol:

385.920516

ΔHf, kcal/mol:

-509.37

Dipole, Da:

20.97

IP(EA), eV:

 -9.11(-6.25)

Spin(Sz, S2):

 None, None

Charge, e:

 -4

Chem-info

IUPAC name:

[oxido-[oxido-[(3,4,5-trihydroxyoxolan-2-yl)methoxy]phosphoryl]oxyphosphoryl] phosphate

Drug info:

PubChemData

Smile

CC(C)(COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)([O-])[O-])C(C(=O)NCCC(=O)NCCSC(=O)CC(=O)C4=CC=CC=C4O)O

DOS

IR

Vibrations