Geometry & MOs

Info

ID:	199761
PubChem CID:	79292279
Reduced:	SN3O4C12H13 (1)
Stoich.:	AB3C4D12E13 (1)
Weight, g/mol:	263.072848
ΔH_f, kcal/mol:	-116.89
Dipole, Da:	5.12
IP(EA), eV:	-9.45(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-cyclobutylimidazo[4,5-c]pyridin-2-yl)sulfanylacetic acid

Drug info:

PubChemData

Smile

COC(=O)CCN1C2=C(C=NC=C2)N=C1SCC(=O)O

DOS

IR

Vibrations