Geometry & MOs

Info

ID:	429444
PubChem CID:	135169493
Reduced:	FSO3N4H15C16 (1)
Stoich.:	ABC3D4E15F16 (1)
Weight, g/mol:	320.074325
ΔH_f, kcal/mol:	-86.09
Dipole, Da:	2.63
IP(EA), eV:	-8.41(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(2-amino-3-fluoropyridin-4-yl)methoxy]-4-methoxy-1,3-benzothiazol-2-amine

Drug info:

PubChemData

Smile

CC(=O)NC1=NC=CC(=C1F)COC2=CC(=C3C(=C2)SC(=N3)N)OC

DOS

IR

Vibrations