Geometry & MOs

Info

ID:

91150

PubChem CID:

49973699

Reduced:

ClN5O5C31H38 (1)

Stoich.:

AB5C5D31E38 (1)

Weight, g/mol:

575.310769

ΔHf, kcal/mol:

-192.76

Dipole, Da:

6.1

IP(EA), eV:

 -9.09(-0.31)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)N2CCOCC2)NC(=O)CN3CCC(CC3)C(=O)N4CCCC4C(=O)NC5=CC(=CC=C5)Cl

DOS

IR

Vibrations