Geometry & MOs

Info

ID:

108820

PubChem CID:

50260518

Reduced:

ClF3O4N5C33H35 (1)

Stoich.:

AB3C4D5E33F35 (1)

Weight, g/mol:

585.295119

ΔHf, kcal/mol:

-293.34

Dipole, Da:

9.26

IP(EA), eV:

 -8.63(-1.13)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[1-(4-methoxyanilino)-1-oxopropan-2-yl]-1-[2-[2-methyl-4-[(2-methylphenyl)carbamoyl]anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)NC(=O)CN3CCC(CC3)C(=O)NC(C)C(=O)NC4=C(C=CC(=C4)C(F)(F)F)Cl)C

DOS

IR

Vibrations