Geometry & MOs

Info

ID:

412265

PubChem CID:

135085149

Reduced:

AlN2O2C36H52 (1)

Stoich.:

AB2C2D36E52 (1)

Weight, g/mol:

1033.244926

ΔHf, kcal/mol:

-140.15

Dipole, Da:

4.89

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.846360

Charge, e:

 3

Chem-info

IUPAC name:

lithium;[(S)-carboxy(phenyl)methyl]azanide;[1-(2-diphenylphosphaniumylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphanium;ruthenium(2+)

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC2=C(C(=C1)C(C)(C)C)O[Al]OC3=C(C=C(C=C3C(C)(C)C)C(C)(C)C)C=N[C@H]4CCCC[C@@H]4N=C2

DOS

IR

Vibrations