Geometry & MOs

Info

ID:

115369

PubChem CID:

50521000

Reduced:

Cl2O5N6C31H32 (1)

Stoich.:

A2B5C6D31E32 (1)

Weight, g/mol:

558.19936

ΔHf, kcal/mol:

-170.46

Dipole, Da:

9.06

IP(EA), eV:

 -9.0(-0.8)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-(4-acetamido-3-methoxyanilino)-2-oxoethyl]-1-[2-(3-carbamoyl-4-chloroanilino)-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC(=C(C=C1)Cl)NC(=O)C2=CC=CC=C2)NC(=O)C3CCN(CC3)CC(=O)NC4=CC(=C(C=C4)Cl)C(=O)N

DOS

IR

Vibrations