Geometry & MOs

Info

ID:

117797

PubChem CID:

50616424

Reduced:

ClN4O5C29H31 (1)

Stoich.:

AB4C5D29E31 (1)

Weight, g/mol:

567.261232

ΔHf, kcal/mol:

-149.06

Dipole, Da:

5.25

IP(EA), eV:

 -8.72(-0.77)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-(5-carbamoyl-2-chloroanilino)-1-oxopropan-2-yl]-N-[2-methyl-3-(3-methylpiperidine-1-carbonyl)phenyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)OC)NC(=O)C2CCN(CC2)CC(=O)NC3=CC(=C(C=C3)Cl)C(=O)NC4=CC=CC=C4

DOS

IR

Vibrations