Geometry & MOs

Info

ID:

443053

PubChem CID:

135257538

Reduced:

NSO4F5C15H16 (1)

Stoich.:

ABC4D5E15F16 (1)

Weight, g/mol:

634.228855

ΔHf, kcal/mol:

-386.31

Dipole, Da:

3.18

IP(EA), eV:

 -10.02(-1.78)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[(4-cyclohexylphenyl)methyl]-N-[3-hydroxy-4-(2-hydroxypropan-2-yl)phenyl]-1-[methyl-(2,3,4,5,6-pentafluorophenyl)sulfanylamino]cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)[C@H]1CCCN1S(=O)(=O)C2=C(C(=C(C(=C2F)F)F)F)F

DOS

IR

Vibrations