Geometry & MOs

Info

ID:

111228

PubChem CID:

50359453

Reduced:

N3O3C15H19 (2)

Stoich.:

A3B3C15D19 (2)

Weight, g/mol:

606.316583

ΔHf, kcal/mol:

-229.62

Dipole, Da:

9.26

IP(EA), eV:

 -8.83(-0.56)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-[3-(dimethylcarbamoyl)-2-methylanilino]-2-oxoethyl]-1-[2-[2-methyl-3-(morpholine-4-carbonyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)CNC(=O)C2CCN(CC2)CC(=O)NC3=CC=CC(=C3C)C(=O)N4CCOCC4)C(=O)N

DOS

IR

Vibrations