Geometry & MOs

Info

ID:	429383
PubChem CID:	135169406
Reduced:	FON2C10H17 (1)
Stoich.:	ABC2D10E17 (1)
Weight, g/mol:	304.068177
ΔH_f, kcal/mol:	-70.25
Dipole, Da:	2.46
IP(EA), eV:	-8.27(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-fluoro-4-methoxy-6-phenylmethoxy-1,3-benzothiazol-2-amine

Drug info:

PubChemData

Smile

C1CCN(C1)/C(=C\F)/N2CCOCC2

DOS

IR

Vibrations