Geometry & MOs

Info

ID:

103655

PubChem CID:

50072119

Reduced:

FN5O6C33H36 (1)

Stoich.:

AB5C6D33E36 (1)

Weight, g/mol:

666.352969

ΔHf, kcal/mol:

-238.44

Dipole, Da:

5.97

IP(EA), eV:

 -8.3(-0.6)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[2-methyl-5-(phenylcarbamoyl)anilino]-1-oxopropan-2-yl]-N-[1-oxo-1-[2-(piperidine-1-carbonyl)anilino]propan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)F)NC(=O)C(C)N3CCC(CC3)C(=O)NCC(=O)NC4=CC5=C(C=C4)OCCO5

DOS

IR

Vibrations