Geometry & MOs

Info

ID:

96943

PubChem CID:

50026216

Reduced:

NOC7H8 (6)

Stoich.:

ABC7D8 (6)

Weight, g/mol:

718.347883

ΔHf, kcal/mol:

-191.57

Dipole, Da:

5.46

IP(EA), eV:

 -8.22(-0.31)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[1-(4-benzamido-3-methoxyanilino)-3-methyl-1-oxobutan-2-yl]-1-[2-[2-methyl-5-(phenylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)C(C(C)C)NC(=O)C3CCN(CC3)CC(=O)NC4=C(C=CC(=C4)C(=O)NC5=CC=CC=C5)C)OC

DOS

IR

Vibrations