Geometry & MOs

Info

ID:

158858

PubChem CID:

57244099

Reduced:

N3O8C35H37 (1)

Stoich.:

A3B8C35D37 (1)

Weight, g/mol:

652.59068

ΔHf, kcal/mol:

-278.42

Dipole, Da:

5.32

IP(EA), eV:

 -8.78(-0.82)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

phenyl-[2,2,6,6-tetramethyl-1-(2,2,6,6-tetramethyl-4-octadecoxypiperidin-1-yl)piperidin-4-yl]methanone

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)OCOC(=O)C[C@@H]1C[C@H](NC1=O)COC2=CC3=C(C=C2)C4=C(C3)C=C(C=C4)C(=NC(=O)OCC5=CC=CC=C5)N

DOS

IR

Vibrations