Geometry & MOs

Info

ID:	80230
PubChem CID:	49833659
Reduced:	F2N3O4H9C14 (1)
Stoich.:	A2B3C4D9E14 (1)
Weight, g/mol:	436.109293
ΔH_f, kcal/mol:	-124.73
Dipole, Da:	2.61
IP(EA), eV:	-9.73(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3'-(6-methylsulfonylpyridin-3-yl)oxy-6-phenoxyspiro[1,2-dihydroindene-3,5'-4H-1,2-oxazole]

Drug info:

PubChemData

Smile

C1C(ON=C1OC2=CN=CN=C2)C3=CC4=C(C=C3)OC(O4)(F)F

DOS

IR

Vibrations