Geometry & MOs

Info

ID:

163732

PubChem CID:

58874714

Reduced:

SF3N5O5H32C35 (1)

Stoich.:

AB3C5D5E32F35 (1)

Weight, g/mol:

632.339627

ΔHf, kcal/mol:

-210.1

Dipole, Da:

7.66

IP(EA), eV:

 -8.83(-1.31)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[3-(benzenesulfonamido)-1-cyclohexyl-3-oxopropyl]-3-[benzyl(methyl)amino]-4-[methyl(3-methylbutyl)amino]benzamide

Drug info:

PubChemData

Smile

CC(C)CCN(C)C1=C(C=C(C=C1)C2=NOC(=N2)C3=CC(=CC=C3)C(=O)NS(=O)(=O)C4=CC=CC=C4)NC(=O)C5=CC(=CC=C5)C(F)(F)F

DOS

IR

Vibrations