Geometry & MOs

Info

ID:

411837

PubChem CID:

135084682

Reduced:

NPO4H54C62 (1)

Stoich.:

ABC4D54E62 (1)

Weight, g/mol:

743.138477

ΔHf, kcal/mol:

19.2

Dipole, Da:

3.4

IP(EA), eV:

 -8.6(-0.49)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methanone;ruthenium(3+);5,10,15,20-tetraphenylporphyrin-22,24-diide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1)N([C@@H](C)C2=CC=CC=C2)P3OC([C@H]([C@@H](C(O3)(C4=CC5=CC=CC=C5C=C4)C6=CC7=CC=CC=C7C=C6)OC)OC)(C8=CC9=CC=CC=C9C=C8)C1=CC2=CC=CC=C2C=C1

DOS

IR

Vibrations