Geometry & MOs

Info

ID:	200996
PubChem CID:	79472133
Reduced:	O2N6C11H12 (1)
Stoich.:	A2B6C11D12 (1)
Weight, g/mol:	248.061949
ΔH_f, kcal/mol:	34.77
Dipole, Da:	9.87
IP(EA), eV:	-9.05(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-([1,3]thiazolo[5,4-b]pyridin-2-yl)cyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C(C)C1=NNC2=C3C(=NC=N3)N=CN21

DOS

IR

Vibrations