Geometry & MOs

Info

ID:	181270
PubChem CID:	76725877
Reduced:	ClN2F3O3C23H32 (1)
Stoich.:	AB2C3D3E23F32 (1)
Weight, g/mol:	548.244185
ΔH_f, kcal/mol:	-333.17
Dipole, Da:	5.75
IP(EA), eV:	-9.39(-0.12)
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]-3-(3-methoxyphenyl)benzamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N1CCC(C(C1)(C)C)(C2=CC=C(C=C2)Cl)O)NC(=O)CC(C)C(F)(F)F

DOS

IR

Vibrations