Geometry & MOs

Info

ID:	242159
PubChem CID:	96079425
Reduced:	FSN3H10C13 (1)
Stoich.:	ABC3D10E13 (1)
Weight, g/mol:	259.057947
ΔH_f, kcal/mol:	39.29
Dipole, Da:	3.66
IP(EA), eV:	-9.38(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(S)-(2-fluorophenyl)-([1,3]thiazolo[5,4-b]pyridin-2-yl)methanamine

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)[C@@H](C2=NC3=C(S2)C=NC=C3)N)F

DOS

IR

Vibrations