Geometry & MOs

Info

ID:

296727

PubChem CID:

117590496

Reduced:

ON5C14H17 (1)

Stoich.:

AB5C14D17 (1)

Weight, g/mol:

490.09674

ΔHf, kcal/mol:

68.69

Dipole, Da:

5.7

IP(EA), eV:

-8.58(-0.81)

Spin(Sz, S2):

None, None

Charge, e:

-3

Chem-info

IUPAC name:

iridium;(Z)-4-oxopent-2-en-2-olate

Drug info:

PubChemData

Smile

CCCNC1=NN(N=C1C#N)C2=CC=C(C=C2)OCC

DOS

IR

Vibrations