Geometry & MOs

Info

ID:	257488
PubChem CID:	103146546
Reduced:	NSF2O3C13H19 (1)
Stoich.:	ABC2D3E13F19 (1)
Weight, g/mol:	269.033349
ΔH_f, kcal/mol:	-224.0
Dipole, Da:	3.54
IP(EA), eV:	-9.49(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2-[2-(2,2,2-trifluoroethoxy)ethyl]-1,3-thiazole-5-carboxylic acid

Drug info:

PubChemData

Smile

CCOC(=O)C(C)(C)C1=CSC(=N1)CCOCC(F)F

DOS

IR

Vibrations