Geometry & MOs

Info

ID:

111771

PubChem CID:

50380844

Reduced:

N5O6C31H39 (1)

Stoich.:

A5B6C31D39 (1)

Weight, g/mol:

579.305684

ΔHf, kcal/mol:

-223.5

Dipole, Da:

5.23

IP(EA), eV:

 -8.96(-0.4)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]-1-[1-[2-methyl-3-(morpholine-4-carbonyl)anilino]-1-oxopropan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)C(C)N2CCC(CC2)C(=O)NCC(=O)NC3=CC=CC(=C3)C(=O)C)C(=O)N4CCOCC4

DOS

IR

Vibrations