Geometry & MOs

Info

ID:

384912

PubChem CID:

134977930

Reduced:

CoO4H5C9 (2)

Stoich.:

AB4C5D9 (2)

Weight, g/mol:

724.004368

ΔHf, kcal/mol:

-128.62

Dipole, Da:

31.09

IP(EA), eV:

 -9.55(-5.3)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(1R,4Z,8R,10R)-1-[tert-butyl(dimethyl)silyl]oxy-8-hydroxy-10-phenylsulfanylbicyclo[7.3.1]tridec-4-en-2,6-diyn-13-one;carbon monoxide;cobalt

Drug info:

PubChemData

Smile

[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1CC2(C#C/C=C\C#CCC1C2=O)O.[Co].[Co]

DOS

IR

Vibrations