Geometry & MOs

Info

ID:	199817
PubChem CID:	79300881
Reduced:	SF3N3C10H10 (1)
Stoich.:	AB3C3D10E10 (1)
Weight, g/mol:	291.104148
ΔH_f, kcal/mol:	-123.92
Dipole, Da:	7.47
IP(EA), eV:	-8.67(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(1-cyclopropylethyl)-6-methylimidazo[4,5-b]pyridin-2-yl]sulfanylacetic acid

Drug info:

PubChemData

Smile

CC1=CC2=C(N=C1)N(C(=S)N2)CCC(F)(F)F

DOS

IR

Vibrations