Geometry & MOs

Info

ID:	288850
PubChem CID:	104326926
Reduced:	FON2C16H25 (1)
Stoich.:	ABC2D16E25 (1)
Weight, g/mol:	282.047442
ΔH_f, kcal/mol:	-85.81
Dipole, Da:	4.94
IP(EA), eV:	-8.09(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-ethoxy-3-fluoroanilino)-1,3-thiazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)N2CCCC(C2)NC(C)C)F

DOS

IR

Vibrations