Geometry & MOs

Info

ID:

111277

PubChem CID:

50360666

Reduced:

FO5N6C38H45 (1)

Stoich.:

AB5C6D38E45 (1)

Weight, g/mol:

620.332233

ΔHf, kcal/mol:

-233.53

Dipole, Da:

5.84

IP(EA), eV:

 -8.47(-0.69)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[2-[2-methyl-3-(morpholine-4-carbonyl)anilino]-2-oxoethyl]-N-[2-[2-methyl-6-(propan-2-ylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)NC(=O)CCNC(=O)C2CCN(CC2)CC(=O)NC3=CC=CC(=C3C)C(=O)NC4CCCC4)NC(=O)C5=CC=C(C=C5)F

DOS

IR

Vibrations