Geometry & MOs

Info

ID:	172134
PubChem CID:	75471150
Reduced:	OSF3N3H16C19 (1)
Stoich.:	ABC3D3E16F19 (1)
Weight, g/mol:	397.026345
ΔH_f, kcal/mol:	-120.34
Dipole, Da:	4.72
IP(EA), eV:	-8.52(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1C)C2=CSC(=N2)NC(=O)C3=C(C=CC=N3)C(F)(F)F)C

DOS

IR

Vibrations