Geometry & MOs

Info

ID:

119829

PubChem CID:

50703813

Reduced:

ClF3N5O5C32H33 (1)

Stoich.:

AB3C5D5E32F33 (1)

Weight, g/mol:

597.195439

ΔHf, kcal/mol:

-327.73

Dipole, Da:

7.8

IP(EA), eV:

 -8.56(-0.8)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[2-[2-chloro-5-(phenylcarbamoyl)anilino]-2-oxoethyl]-N-[3-(3,4-difluoroanilino)-3-oxopropyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)Cl)NC(=O)C(C)N3CCC(CC3)C(=O)NCC(=O)NC4=CC=CC=C4OC(F)(F)F

DOS

IR

Vibrations