Geometry & MOs

Info

ID:

189681

PubChem CID:

77888472

Reduced:

NO4C20H29 (1)

Stoich.:

AB4C20D29 (1)

Weight, g/mol:

656.293479

ΔHf, kcal/mol:

-185.17

Dipole, Da:

3.1

IP(EA), eV:

 -9.49(0.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-2-[bis[(1-oxo-1-propan-2-yloxypropan-2-yl)amino]phosphoryloxymethyl]-4-hydroxy-4-methyloxolan-3-yl] 2-methylpropanoate

Drug info:

PubChemData

Smile

CCCCOCC(C(C)C)C(=O)N1C(COC1=O)CC2=CC=CC=C2

DOS

IR

Vibrations