Geometry & MOs

Info

ID:

120426

PubChem CID:

50726545

Reduced:

Cl2O5N6C34H36 (1)

Stoich.:

A2B5C6D34E36 (1)

Weight, g/mol:

702.216902

ΔHf, kcal/mol:

-164.77

Dipole, Da:

8.62

IP(EA), eV:

 -9.21(-1.09)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[2-[2-chloro-5-(phenylcarbamoyl)anilino]-2-oxoethyl]-N-[2-[4-[(2,5-difluorophenyl)carbamoyl]anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)C2=C(C=C(C=C2)NC(=O)CNC(=O)C3CCN(CC3)CC(=O)NC4=C(C=CC(=C4)C(=O)NC5=CC=CC=C5)Cl)Cl

DOS

IR

Vibrations