Geometry & MOs

Info

ID:

111580

PubChem CID:

50373564

Reduced:

ClO5N6C37H49 (1)

Stoich.:

AB5C6D37E49 (1)

Weight, g/mol:

575.347155

ΔHf, kcal/mol:

-235.47

Dipole, Da:

2.81

IP(EA), eV:

 -8.98(-0.64)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[3-(cyclopentylcarbamoyl)-2-methylanilino]-1-oxopropan-2-yl]-N-[3-(2,5-dimethylanilino)-3-oxopropyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)C(C)N2CCC(CC2)C(=O)NC(C)C(=O)NC3=CC(=C(C=C3)C(=O)NC4CCCC4)Cl)C(=O)NC5CCCC5

DOS

IR

Vibrations