Geometry & MOs

Info

ID:

381860

PubChem CID:

134972715

Reduced:

CrSiO9C34H40 (1)

Stoich.:

ABC9D34E40 (1)

Weight, g/mol:

532.210091

ΔHf, kcal/mol:

-338.09

Dipole, Da:

3.89

IP(EA), eV:

 -7.91(-0.26)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[[4-[tert-butyl(dimethyl)silyl]oxy-2,6-dimethylphenyl]-[(4-methyl-5-phenylmethoxypent-2-ynoxy)methoxy]methylidene]chromium

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C(=[Cr])OCOCC#CC(C)COCC2=CC=CC=C2)C)O[Si](C)(C)C(C)(C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+]

DOS

IR

Vibrations