Geometry & MOs

Info

ID:

412093

PubChem CID:

135084959

Reduced:

RuCl2N4H8F20C44 (1)

Stoich.:

AB2C4D8E20F44 (1)

Weight, g/mol:

513.160325

ΔHf, kcal/mol:

-292.47

Dipole, Da:

7.03

IP(EA), eV:

 -7.82(-3.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

copper;(6Z)-6-[[[(1R)-1-phenylethyl]amino]methylidene]cyclohexa-2,4-dien-1-one

Drug info:

PubChemData

Smile

C1=CC2=C(C3=NC(=C(C4=CC=C([N-]4)C(=C5C=CC(=N5)C(=C1[N-]2)C6=C(C(=C(C(=C6F)F)F)F)F)C7=C(C(=C(C(=C7F)F)F)F)F)C8=C(C(=C(C(=C8F)F)F)F)F)C=C3)C9=C(C(=C(C(=C9F)F)F)F)F.Cl[Ru+2]Cl

DOS

IR

Vibrations