Geometry & MOs

Info

ID:

221224

PubChem CID:

85261566

Reduced:

BrSi2O3C26H45 (1)

Stoich.:

AB2C3D26E45 (1)

Weight, g/mol:

472.439264

ΔHf, kcal/mol:

-228.7

Dipole, Da:

5.41

IP(EA), eV:

 -8.33(0.0)

Spin(Sz, S2):

 None, None

Charge, e:

 2

Chem-info

IUPAC name:

ethyl-[15-[1-[ethyl(dimethyl)azaniumyl]ethyl]-14-hydroxy-12,16-dimethyl-7-methylidene-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-dimethylazanium

Drug info:

PubChemData

Smile

CC1CC(=CC(C1CC2=CC(=C(C=C2O[Si](C)(C)C(C)(C)C)Br)OC)(C[Si](C)(C)C)O)C

DOS

IR

Vibrations