Geometry & MOs

Info

ID:

119362

PubChem CID:

50680828

Reduced:

Cl2N6O6C37H48 (1)

Stoich.:

A2B6C6D37E48 (1)

Weight, g/mol:

659.15101

ΔHf, kcal/mol:

-270.88

Dipole, Da:

5.49

IP(EA), eV:

 -9.11(-0.8)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(2-bromophenyl)-1-[1-[2-[2-chloro-5-(morpholine-4-carbonyl)anilino]-2-oxoethyl]piperidine-4-carbonyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NC1=C(C=CC(=C1)Cl)C(=O)NC2CCCCC2)NC(=O)C3CCN(CC3)CC(=O)NC4=C(C=CC(=C4)C(=O)N5CCOCC5)Cl

DOS

IR

Vibrations