Geometry & MOs

Info

ID:	196136
PubChem CID:	78788091
Reduced:	ClF2N2O2C19H21 (1)
Stoich.:	AB2C2D2E19F21 (1)
Weight, g/mol:	411.234434
ΔH_f, kcal/mol:	-158.97
Dipole, Da:	2.13
IP(EA), eV:	-9.39(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

piperidin-1-yl-[1-[[2-(4-propan-2-ylphenyl)-1,3-thiazol-5-yl]methyl]piperidin-4-yl]methanone

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1Cl)NCC(=O)N(C)CC2=CC=C(C=C2)OC(F)F

DOS

IR

Vibrations