Geometry & MOs

Info

ID:

47082

PubChem CID:

10529464

Reduced:

SSiO4C28H42 (1)

Stoich.:

ABC4D28E42 (1)

Weight, g/mol:

502.151548

ΔHf, kcal/mol:

-189.23

Dipole, Da:

7.5

IP(EA), eV:

 -8.82(-0.58)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(NZ)-N-[[(2S)-2-(4-chlorophenyl)-2-(diethylamino)ethyl]-(4-methylphenyl)-lambda4-sulfanylidene]-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

C[C@H]1[C@@H]2[C@@H](CC([C@H](/C=C\[C@@]2(C=CC1=O)C)O[Si](C)(C)C(C)(C)C)(C)C)S(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations