Geometry & MOs

Info

ID:

443111

PubChem CID:

135257725

Reduced:

OSF5N6H25C28 (1)

Stoich.:

ABC5D6E25F28 (1)

Weight, g/mol:

635.187718

ΔHf, kcal/mol:

-119.33

Dipole, Da:

3.85

IP(EA), eV:

 -9.26(-1.45)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2R)-N-[(4-cyclohexylphenyl)methyl]-2-[methyl-(2,3,4,5,6-pentafluorophenyl)sulfonylamino]-N-(1-oxo-2,3-dihydroisoindol-5-yl)propanamide

Drug info:

PubChemData

Smile

C1CCC(CC1)C2=CC=C(C=C2)CN(C3=CC=C(C=C3)C4=NNN=N4)C(=O)CNSC5=C(C(=C(C(=C5F)F)F)F)F

DOS

IR

Vibrations