Geometry & MOs

Info

ID:

412515

PubChem CID:

135085410

Reduced:

ClNORuC15H29 (1)

Stoich.:

ABCDE15F29 (1)

Weight, g/mol:

696.254572

ΔHf, kcal/mol:

29.26

Dipole, Da:

5.35

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 2.779828

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

[CH3-].CC.CCC[N-]C[C@H](C)O.C1=CC=CC=C1.Cl[Ru+2]

DOS

IR

Vibrations