Geometry & MOs

Info

ID:	206822
PubChem CID:	80306091
Reduced:	FSN2O2C15H17 (1)
Stoich.:	ABC2D2E15F17 (1)
Weight, g/mol:	308.099477
ΔH_f, kcal/mol:	-95.54
Dipole, Da:	2.17
IP(EA), eV:	-8.86(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-[1-(3-fluoro-4-methylphenyl)ethylamino]-1,3-thiazole-4-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(SC=N1)NCCC2=C(C=C(C=C2)F)C

DOS

IR

Vibrations