Geometry & MOs

Info

ID:

230167

PubChem CID:

87570343

Reduced:

SiO2F3N3C17H24 (1)

Stoich.:

AB2C3D3E17F24 (1)

Weight, g/mol:

620.202223

ΔHf, kcal/mol:

-205.32

Dipole, Da:

4.61

IP(EA), eV:

 -8.94(-0.58)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[(1S)-1-cyano-2-(4-cyano-2,6-difluorophenyl)ethyl]-2-[[(1S)-1-[4-[4-[(1R)-2,2-difluoro-1-hydroxyethyl]phenyl]phenyl]-2,2,2-trifluoroethyl]amino]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OCC1=CC(=NO1)CC(CCC(F)(F)F)(C#N)C#N

DOS

IR

Vibrations