Geometry & MOs

Info

ID:	380171
PubChem CID:	134970520
Reduced:	NCl3O8C14H18 (1)
Stoich.:	AB3C8D14E18 (1)
Weight, g/mol:	449.09257
ΔH_f, kcal/mol:	-352.42
Dipole, Da:	3.75
IP(EA), eV:	-10.68(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[4-bromo-2-(trifluoromethyl)phenyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide

Drug info:

PubChemData

Smile

CC1[C@@H](C(C([C@@H](O1)OC(=N)C(Cl)(Cl)Cl)OC(=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations