Geometry & MOs

Info

ID:

107518

PubChem CID:

50206697

Reduced:

ClO5N6C43H55 (1)

Stoich.:

AB5C6D43E55 (1)

Weight, g/mol:

624.282696

ΔHf, kcal/mol:

-223.39

Dipole, Da:

8.38

IP(EA), eV:

 -8.8(-0.48)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CCCCC1NC(=O)C2=CC(=C(C=C2)NC(=O)C(C)N3CCC(CC3)C(=O)NC(C(C)C)C(=O)NC4=C(C=CC(=C4)NC(=O)C5=CC=CC=C5C)Cl)C

DOS

IR

Vibrations