Geometry & MOs

Info

ID:

398291

PubChem CID:

135032675

Reduced:

N2C33H36 (1)

Stoich.:

A2B33C36 (1)

Weight, g/mol:

478.211678

ΔHf, kcal/mol:

82.52

Dipole, Da:

0.83

IP(EA), eV:

 -8.4(0.14)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3Z)-2-cyclohexyl-3-(4-phenylbut-3-yn-2-ylidene)-2-(2-phenylethynyl)-2-silatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaene

Drug info:

PubChemData

Smile

CC(C)C1=CC=CC=C1N2CN([C@@H]([C@H]2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5C(C)C

DOS

IR

Vibrations