Geometry & MOs

Info

ID:

118696

PubChem CID:

50654647

Reduced:

ClN5O5C28H36 (1)

Stoich.:

AB5C5D28E36 (1)

Weight, g/mol:

571.256147

ΔHf, kcal/mol:

-193.52

Dipole, Da:

8.41

IP(EA), eV:

 -8.76(-0.54)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[2-chloro-5-(propylcarbamoyl)anilino]-1-oxopropan-2-yl]-N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCCNC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C(C)N2CCC(CC2)C(=O)NCC(=O)NC3=CC=CC=C3OC

DOS

IR

Vibrations