Geometry & MOs

Info

ID:	153682
PubChem CID:	56312973
Reduced:	O3N4F6H14C15 (1)
Stoich.:	A3B4C6D14E15 (1)
Weight, g/mol:	457.164697
ΔH_f, kcal/mol:	-362.2
Dipole, Da:	5.01
IP(EA), eV:	-8.81(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]-N-[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]propanamide

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)CCC(=O)NC2=NNC(=N2)C(F)(F)F)OCC(F)(F)F

DOS

IR

Vibrations