Geometry & MOs

Info

ID:

48747

PubChem CID:

11528290

Reduced:

ON2Si8C79H176 (1)

Stoich.:

AB2C8D79E176 (1)

Weight, g/mol:

1419.770208

ΔHf, kcal/mol:

-536.59

Dipole, Da:

4.42

IP(EA), eV:

-8.99(1.58)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

11,20,38,47-tetrakis(3,5-ditert-butylphenyl)heptacyclo[28.24.0.03,28.08,13.018,23.035,40.045,50]tetrapentaconta-1,3,4,5,6,7,9,11,13,14,15,16,17,19,21,23,24,25,26,27,29,35(40),36,38,45(50),46,48-heptacosaen-31,33,41,43,51,53-hexayne

Drug info:

PubChemData

Smile

CCC[Si](CCC)(CCC)CCC[Si](CCCNC(=O)NCCC[Si](CCC[Si](CCC)(CCC)CCC)(CCC[Si](CCC)(CCC)CCC)CCC[Si](CCC)(CCC)CCC)(CCC[Si](CCC)(CCC)CCC)CCC[Si](CCC)(CCC)CCC

DOS

IR

Vibrations