Geometry & MOs

Info

ID:

412200

PubChem CID:

135085075

Reduced:

NORh2C6H12 (1)

Stoich.:

ABC2D6E12 (1)

Weight, g/mol:

997.96886

ΔHf, kcal/mol:

1.55

Dipole, Da:

17.36

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.755743

Charge, e:

 -4

Chem-info

IUPAC name:

methyl(phenyl)azanide;trichlorotantalum

Drug info:

PubChemData

Smile

C1CCC([N-]CC1)O.[Rh].[Rh]

DOS

IR

Vibrations