Geometry & MOs

Info

ID:

412210

PubChem CID:

135085093

Reduced:

RuN3O3C21H21 (1)

Stoich.:

AB3C3D21E21 (1)

Weight, g/mol:

885.214708

ΔHf, kcal/mol:

-3.76

Dipole, Da:

5.89

IP(EA), eV:

 -7.87(-2.35)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

iron(2+);[6-[[(2S)-2-[(2S)-1-[(1-methylbenzimidazol-2-yl)methyl]pyrrolidin-2-yl]pyrrolidin-1-yl]methyl]pyridin-3-yl]-tri(propan-2-yl)silane;trifluoromethanesulfonate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=NC(=C2)C3=CC=CC=N3)C4=CC=CC=N4.O.O.O.[Ru]

DOS

IR

Vibrations