Geometry & MOs

Info

ID:	272603
PubChem CID:	103749829
Reduced:	N3F4C11H13 (1)
Stoich.:	A3B4C11D13 (1)
Weight, g/mol:	240.054419
ΔH_f, kcal/mol:	-146.68
Dipole, Da:	8.41
IP(EA), eV:	-9.26(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-ethyl-1,3-thiazol-2-yl)amino]-1,1,1-trifluoropropan-2-ol

Drug info:

PubChemData

Smile

CN1CCCC1CNC2=C(C(=NC(=C2F)F)F)F

DOS

IR

Vibrations