Geometry & MOs

Info

ID:	172133
PubChem CID:	75471149
Reduced:	OSF3N3H12C20 (1)
Stoich.:	ABC3D3E12F20 (1)
Weight, g/mol:	391.096618
ΔH_f, kcal/mol:	-74.88
Dipole, Da:	5.6
IP(EA), eV:	-8.66(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC=C2C3=CSC(=N3)NC(=O)C4=C(C=CC=N4)C(F)(F)F

DOS

IR

Vibrations