Geometry & MOs

Info

ID:	265103
PubChem CID:	103510549
Reduced:	F3N3O3C11H12 (1)
Stoich.:	A3B3C3D11E12 (1)
Weight, g/mol:	269.083413
ΔH_f, kcal/mol:	-250.06
Dipole, Da:	5.62
IP(EA), eV:	-9.89(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-3-(3-methylimidazole-4-carbonyl)-1,3-thiazolidine-4-carboxylic acid

Drug info:

PubChemData

Smile

CN1C=NC=C1C(=O)N2CCC(C2)(C(=O)O)C(F)(F)F

DOS

IR

Vibrations