Geometry & MOs

Info

ID:

116313

PubChem CID:

50556429

Reduced:

ClN6O6C37H43 (1)

Stoich.:

AB6C6D37E43 (1)

Weight, g/mol:

740.321974

ΔHf, kcal/mol:

-212.32

Dipole, Da:

7.84

IP(EA), eV:

 -8.5(-0.44)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N,1-bis[1-[4-chloro-3-(3-methylpiperidine-1-carbonyl)anilino]-1-oxopropan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C(C)NC(=O)C2CCN(CC2)CC(=O)NC3=CC(=C(C=C3)Cl)C(=O)N4CCCC4)NC(=O)C5=CC(=CC=C5)OC

DOS

IR

Vibrations