Geometry & MOs

Info

ID:

117191

PubChem CID:

50594138

Reduced:

Cl2O5N6C32H38 (1)

Stoich.:

A2B5C6D32E38 (1)

Weight, g/mol:

556.245248

ΔHf, kcal/mol:

-213.65

Dipole, Da:

8.5

IP(EA), eV:

 -9.03(-0.62)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[4-chloro-3-(cyclopentylcarbamoyl)anilino]-1-oxopropan-2-yl]-N-(2,4-dimethoxyphenyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)NC(=O)C2=C(C=CC(=C2)NC(=O)CN3CCC(CC3)C(=O)N4CCCC4C(=O)NC5=CC(=C(C=C5)Cl)C(=O)N)Cl

DOS

IR

Vibrations