Geometry & MOs

Info

ID:

120576

PubChem CID:

50735355

Reduced:

FO5N6C32H35 (1)

Stoich.:

AB5C6D32E35 (1)

Weight, g/mol:

552.269633

ΔHf, kcal/mol:

-205.0

Dipole, Da:

5.13

IP(EA), eV:

 -8.52(-0.77)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[1-(3-acetamido-4-methoxyanilino)-1-oxopropan-2-yl]-1-[1-(2-carbamoylanilino)-1-oxopropan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2F)NC(=O)C3CCN(CC3)C(C)C(=O)NC4=CC=CC=C4C(=O)N

DOS

IR

Vibrations