Geometry & MOs

Info

ID:

105905

PubChem CID:

50142020

Reduced:

O5N6C31H42 (1)

Stoich.:

A5B6C31D42 (1)

Weight, g/mol:

618.352969

ΔHf, kcal/mol:

-209.11

Dipole, Da:

5.46

IP(EA), eV:

 -9.02(-0.53)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-[4-(3-methylpiperidine-1-carbonyl)anilino]-2-oxoethyl]-1-[2-[2-methyl-4-(propylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCCNC(=O)C1=CC(=C(C=C1)NC(=O)CN2CCC(CC2)C(=O)NCC(=O)NC3=CC=C(C=C3)C(=O)NC(C)C)C

DOS

IR

Vibrations