Geometry & MOs

Info

ID:	180814
PubChem CID:	76690054
Reduced:	IrN3C14H18 (1)
Stoich.:	AB3C14D18 (1)
Weight, g/mol:	559.95653
ΔH_f, kcal/mol:	196.84
Dipole, Da:	7.63
IP(EA), eV:	-8.83(-4.79)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

carbanide;iridium;2-methylsulfanyl-12H-imidazo[1,2-f]phenanthridin-12-ide;yttrium

Drug info:

PubChemData

Smile

CC1=NN([C-]=C1)C2=NC=CC(=C2)CC(C)(C)C.[Ir]

DOS

IR

Vibrations