Geometry & MOs

Info

ID:

409369

PubChem CID:

135082150

Reduced:

SiC30H42 (2)

Stoich.:

AB30C42 (2)

Weight, g/mol:

1294.89366

ΔHf, kcal/mol:

113.42

Dipole, Da:

0.3

IP(EA), eV:

 -8.34(-1.06)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(3E,9E)-14-(3,5-ditert-butylphenyl)-3-[4-(3,5-ditert-butylphenyl)buta-1,3-diynyl]-4,9,10-tris[2-tri(propan-2-yl)silylethynyl]tetradeca-3,9-dien-1,5,7,11,13-pentaynyl]-tri(propan-2-yl)silane

Drug info:

PubChemData

Smile

CC(C)[Si](C#C/C(=C(\C#CC#CC1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C)/C#C[Si](C(C)C)(C(C)C)C(C)C)/C#CC#CC2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C)(C(C)C)C(C)C

DOS

IR

Vibrations