Geometry & MOs

Info

ID:	181269
PubChem CID:	76725586
Reduced:	ClN2O4C26H33 (1)
Stoich.:	AB2C4D26E33 (1)
Weight, g/mol:	476.205355
ΔH_f, kcal/mol:	-179.03
Dipole, Da:	4.09
IP(EA), eV:	-9.48(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]-3-methyl-1-oxobutan-2-yl]-4,4,4-trifluoro-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N1CCC(C(C1)(C)C)(C2=CC=C(C=C2)Cl)O)NC(=O)CC3=CC(=CC=C3)O

DOS

IR

Vibrations