Geometry & MOs

Info

ID:

410708

PubChem CID:

135083509

Reduced:

BSiC16H25 (1)

Stoich.:

ABC16D25 (1)

Weight, g/mol:

662.101298

ΔHf, kcal/mol:

12.85

Dipole, Da:

2.01

IP(EA), eV:

 -8.89(0.02)

Spin(Sz, S2):

 None, None

Charge, e:

 -1

Chem-info

IUPAC name:

[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] [(2S,3S,5S)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate

Drug info:

PubChemData

Smile

B\1(C(=C([Si](/C1=C/CC=C)(C)C)C)CC=C)CC=C

DOS

IR

Vibrations