Geometry & MOs

Info

ID:	341043
PubChem CID:	127263478
Reduced:	FIN2O4C9H10 (1)
Stoich.:	ABC2D4E9F10 (1)
Weight, g/mol:	242.072513
ΔH_f, kcal/mol:	-192.94
Dipole, Da:	4.4
IP(EA), eV:	-10.09(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-methoxyethyl)-6,7-dihydro-5H-[1,3]thiazolo[4,5-b]pyridine-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H](C(O2)CI)O)F

DOS

IR

Vibrations