Geometry & MOs

Info

ID:

106671

PubChem CID:

50172601

Reduced:

F2N6O6C35H38 (1)

Stoich.:

A2B6C6D35E38 (1)

Weight, g/mol:

640.300933

ΔHf, kcal/mol:

-284.0

Dipole, Da:

7.61

IP(EA), eV:

 -9.09(-1.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[2-[2-methyl-4-(morpholine-4-carbonyl)anilino]-2-oxoethyl]-N-[2-oxo-2-[2-(phenylcarbamoyl)anilino]ethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)N2CCOCC2)NC(=O)CN3CCC(CC3)C(=O)NCC(=O)NC4=CC=CC=C4C(=O)NC5=C(C=C(C=C5)F)F

DOS

IR

Vibrations