Geometry & MOs

Info

ID:

117215

PubChem CID:

50595051

Reduced:

Cl3O4N5C29H34 (1)

Stoich.:

A3B4C5D29E34 (1)

Weight, g/mol:

605.197188

ΔHf, kcal/mol:

-173.47

Dipole, Da:

8.47

IP(EA), eV:

 -9.16(-0.69)

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-(3-chloro-4-fluoroanilino)-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC(=C(C=C1)Cl)C(=O)NC2CCCC2)N3CCC(CC3)C(=O)NCC(=O)NC4=CC(=CC(=C4)Cl)Cl

DOS

IR

Vibrations