Geometry & MOs

Info

ID:

440886

PubChem CID:

135232018

Reduced:

N2O2S2H22C23 (1)

Stoich.:

A2B2C2D22E23 (1)

Weight, g/mol:

574.124155

ΔHf, kcal/mol:

22.65

Dipole, Da:

1.45

IP(EA), eV:

 -8.37(-0.65)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(R)-N-[1-(2-cyanopropan-2-ylsulfonyl)-2-[8-(2,2,2-trifluoroethoxy)dibenzothiophen-2-yl]propan-2-yl]-2-methylpropane-2-sulfinamide

Drug info:

PubChemData

Smile

CC#CC1=CC2=C(C=C1)SC3=C2C=C(C=C3)[C@@]4(CS(=O)(=O)[C@@]5(CC5C)C(=N4)N)C

DOS

IR

Vibrations