Geometry & MOs

Info

ID:

127728

PubChem CID:

51012850

Reduced:

SSiN2F3O7C22H37 (1)

Stoich.:

ABC2D3E7F22G37 (1)

Weight, g/mol:

409.252259

ΔHf, kcal/mol:

-502.82

Dipole, Da:

4.11

IP(EA), eV:

 -8.82(-1.11)

Spin(Sz, S2):

 None, None

Charge, e:

 1

Chem-info

IUPAC name:

2,3-dimethylbutan-2-yl-dimethyl-[[(1S,9S,10S)-4-methyl-5-propan-2-yloxy-8,11-dioxa-6-aza-2-azoniatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-10-yl]methoxy]silane

Drug info:

PubChemData

Smile

CC1=C[N+]2=C(N=C1OC(C)C)O[C@H]3C[C@@H]2O[C@H]3CO[Si](C)(C)C(C)(C)C(C)C.C(F)(F)(F)S(=O)(=O)[O-]

DOS

IR

Vibrations