Geometry & MOs

Info

ID:

227212

PubChem CID:

87560633

Reduced:

ClKSO3H9C14 (1)

Stoich.:

ABCD3E9F14 (1)

Weight, g/mol:

614.14046

ΔHf, kcal/mol:

-136.68

Dipole, Da:

9.87

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.412406

Charge, e:

 0

Chem-info

IUPAC name:

[1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ylidene]-[(2-ethoxyphenyl)methylidene]ruthenium;dihydrochloride

Drug info:

PubChemData

Smile

C1=CC=C2C=C3C(=CC2=C1)C=CC(=C3S(=O)(=O)O)Cl.[K]

DOS

IR

Vibrations