Geometry & MOs

Info

ID:

116969

PubChem CID:

50582952

Reduced:

ClFN5O5C34H37 (1)

Stoich.:

ABC5D5E34F37 (1)

Weight, g/mol:

610.267046

ΔHf, kcal/mol:

-214.76

Dipole, Da:

5.78

IP(EA), eV:

 -8.86(-0.5)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[2-[4-chloro-3-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]-N-[2-[2-(dimethylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)F)NC(=O)C3CCN(CC3)CC(=O)NC4=CC(=C(C=C4)Cl)C(=O)NC5CCCC5

DOS

IR

Vibrations