Geometry & MOs

Info

ID:

95844

PubChem CID:

50015701

Reduced:

Cl2O3N4C27H34 (1)

Stoich.:

A2B3C4D27E34 (1)

Weight, g/mol:

577.362805

ΔHf, kcal/mol:

-125.87

Dipole, Da:

6.71

IP(EA), eV:

 -8.81(-0.09)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[5-(diethylcarbamoyl)-2-methylanilino]-1-oxopropan-2-yl]-N-[2-methyl-6-(2-methylpropylcarbamoyl)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)Cl

DOS

IR

Vibrations