Geometry & MOs

Info

ID:

92071

PubChem CID:

49982472

Reduced:

F3O4N5C32H40 (1)

Stoich.:

A3B4C5D32E40 (1)

Weight, g/mol:

565.306433

ΔHf, kcal/mol:

-300.59

Dipole, Da:

8.76

IP(EA), eV:

 -9.25(-0.69)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[2-[5-(cyclopentylcarbamoyl)-2-methylanilino]-2-oxoethyl]-N-[3-(2-fluoro-4-methylanilino)-3-oxopropyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC2CCCC2)NC(=O)CN3CCC(CC3)C(=O)NC(C(C)C)C(=O)NC4=C(C(=C(C=C4)F)F)F

DOS

IR

Vibrations