Geometry & MOs

Info

ID:

98718

PubChem CID:

50045933

Reduced:

Cl2F2O4N5H29C30 (1)

Stoich.:

A2B2C4D5E29F30 (1)

Weight, g/mol:

597.195439

ΔHf, kcal/mol:

-212.78

Dipole, Da:

1.87

IP(EA), eV:

 -9.04(-0.63)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-(2-chloroanilino)-2-oxoethyl]-1-[2-[5-[(2,6-difluorophenyl)carbamoyl]-2-methylanilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC2=C(C=CC=C2F)F)NC(=O)CN3CCC(CC3)C(=O)NCC(=O)NC4=CC(=C(C=C4)Cl)Cl

DOS

IR

Vibrations