Geometry & MOs

Info

ID:

434786

PubChem CID:

135175707

Reduced:

ClSF2N3O6C38H46 (1)

Stoich.:

ABC2D3E6F38G46 (1)

Weight, g/mol:

645.223962

ΔHf, kcal/mol:

-350.9

Dipole, Da:

6.32

IP(EA), eV:

 -9.31(-0.64)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[3-(4-aminopiperidin-1-yl)-1-[4-(4-chlorophenyl)phenyl]-1,1-difluoro-3-oxopropan-2-yl]-4-(cyclohexylmethoxy)benzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1CCN(CC1)C(=O)C(C(C2=CC=C(C=C2)C3=CC=C(C=C3)Cl)(F)F)NS(=O)(=O)C4=CC=C(C=C4)OCC5CCCCC5

DOS

IR

Vibrations