Geometry & MOs

Info

ID:	264618
PubChem CID:	103476431
Reduced:	OSN2F4C11H16 (1)
Stoich.:	ABC2D4E11F16 (1)
Weight, g/mol:	282.101369
ΔH_f, kcal/mol:	-227.04
Dipole, Da:	3.48
IP(EA), eV:	-9.21(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-ethyl-2-(2,2,2-trifluoroethoxymethyl)-1,3-thiazol-5-yl]methyl]ethanamine

Drug info:

PubChemData

Smile

CCC1=C(SC(=N1)COCC(C(F)F)(F)F)CNC

DOS

IR

Vibrations