Geometry & MOs

Info

ID:	412660
PubChem CID:	135085572
Reduced:	ClIrNOC18H19 (1)
Stoich.:	ABCDE18F19 (1)
Weight, g/mol:	515.238365
ΔH_f, kcal/mol:	173.72
Dipole, Da:	27.14
IP(EA), eV:	-9.64(-4.84)
Spin(S_z, S²):	None, None
Charge, e:	3

Chem-info

IUPAC name:

carbanide;ditert-butyl-[[6-(ditert-butylphosphaniumylmethyl)pyridin-2-yl]methyl]phosphanium;ruthenium(2+) monohydride

Drug info:

PubChemData

Smile

[CH3-].COC1=CC=C(C=C1)N=C2CCCC3=CC=C[C-]=C32.Cl[Ir+2]

DOS

IR

Vibrations