Geometry & MOs

Info

ID:	62679
PubChem CID:	26732718
Reduced:	ClNF3O4H11C15 (1)
Stoich.:	ABC3D4E11F15 (1)
Weight, g/mol:	390.101369
ΔH_f, kcal/mol:	-273.1
Dipole, Da:	4.37
IP(EA), eV:	-9.51(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-phenyl-1,3-thiazol-4-yl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=C(C=C(C=C1)Cl)C(F)(F)F)OC(=O)C2=CC=CO2

DOS

IR

Vibrations