Geometry & MOs

Info

ID:

95934

PubChem CID:

50016995

Reduced:

ClN4O4C28H37 (1)

Stoich.:

AB4C4D28E37 (1)

Weight, g/mol:

589.362805

ΔHf, kcal/mol:

-161.51

Dipole, Da:

8.42

IP(EA), eV:

 -8.74(-0.42)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[5-(diethylcarbamoyl)-2-methylanilino]-1-oxopropan-2-yl]-N-[3-(4-methylpiperidine-1-carbonyl)phenyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1=CC(=C(C=C1)C)NC(=O)C(C)N2CCC(CC2)C(=O)NC3=C(C=CC(=C3)Cl)OC

DOS

IR

Vibrations