Geometry & MOs

Info

ID:

51731

PubChem CID:

12014459

Reduced:

NOI2H9C10 (2)

Stoich.:

ABC2D9E10 (2)

Weight, g/mol:

1263.89269

ΔHf, kcal/mol:

55.8

Dipole, Da:

8.9

IP(EA), eV:

 -8.94(-1.55)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(6E)-2,4-dibromo-6-[[[(1R,2R)-2-[[(E)-(3,5-dibromo-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]cyclohexyl]amino]methylidene]cyclohexa-2,4-dien-1-one;ruthenium;triphenylphosphane

Drug info:

PubChemData

Smile

C1C[C@H]([C@@H](CC1)N/C=C\2/C(=O)C(=CC(=C2)I)I)N/C=C\3/C(=O)C(=CC(=C3)I)I

DOS

IR

Vibrations