Geometry & MOs

Info

ID:

113022

PubChem CID:

50429369

Reduced:

O4N5C32H45 (1)

Stoich.:

A4B5C32D45 (1)

Weight, g/mol:

564.306018

ΔHf, kcal/mol:

-181.26

Dipole, Da:

3.22

IP(EA), eV:

 -8.79(-0.13)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-(5-carbamoyl-2-methylanilino)-2-oxoethyl]-1-[2-[3-(diethylcarbamoyl)-2-methylanilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(C)NC(=O)C1=C(C(=CC=C1)NC(=O)C(C)N2CCC(CC2)C(=O)NCCC(=O)NC(C)C3=CC=CC=C3)C

DOS

IR

Vibrations