Geometry & MOs

Info

ID:

410442

PubChem CID:

135083239

Reduced:

BSi6C30H63 (1)

Stoich.:

AB6C30D63 (1)

Weight, g/mol:

352.330131

ΔHf, kcal/mol:

-99.51

Dipole, Da:

2.07

IP(EA), eV:

 -8.16(0.56)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

ethenyl-[(1R,2S,3R,5R)-2,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]-[1-[(1R,2S,3R,5R)-2,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]prop-2-enyl]borane

Drug info:

PubChemData

Smile

B(C1(C=CC2=CC=CC=C21)C)(C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C

DOS

IR

Vibrations