Geometry & MOs

Info

ID:	141646
PubChem CID:	52908056
Reduced:	FSO2N4H11C14 (1)
Stoich.:	ABC2D4E11F14 (1)
Weight, g/mol:	312.039163
ΔH_f, kcal/mol:	5.24
Dipole, Da:	3.71
IP(EA), eV:	-8.92(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[2-(2,2,2-trifluoroethoxycarbonylamino)-1,3-thiazol-4-yl]acetate

Drug info:

PubChemData

Smile

C1C(CN1C2=NC3=C(C=CC=C3S2)F)C(=O)NC4=NOC=C4

DOS

IR

Vibrations