Geometry & MOs

Info

ID:	374354
PubChem CID:	131327370
Reduced:	ClON3C10H10 (1)
Stoich.:	ABC3D10E10 (1)
Weight, g/mol:	222.997096
ΔH_f, kcal/mol:	18.39
Dipole, Da:	10.77
IP(EA), eV:	-8.3(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-5-ethyl-[1,2]thiazolo[4,5-b]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CN1C(=CC(=C2C=CC(=CC2=O)Cl)N1)N

DOS

IR

Vibrations