Geometry & MOs

Info

ID:	180815
PubChem CID:	76690386
Reduced:	IrSYN2H14C17 (1)
Stoich.:	ABCD2E14F17 (1)
Weight, g/mol:	611.03618
ΔH_f, kcal/mol:	84.18
Dipole, Da:	7.99
IP(EA), eV:	-9.2(-4.39)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

[CH3-].CSC1=CN2C3=CC=CC=C3C4=CC=C[C-]=C4C2=N1.[Y].[Ir]

DOS

IR

Vibrations