Geometry & MOs

Info

ID:	204404
PubChem CID:	79960411
Reduced:	ON3C17H25 (1)
Stoich.:	AB3C17D25 (1)
Weight, g/mol:	308.043105
ΔH_f, kcal/mol:	-22.94
Dipole, Da:	2.24
IP(EA), eV:	-8.66(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,4-difluorophenyl)sulfinylmethyl]-1,3-benzoxazol-5-amine

Drug info:

PubChemData

Smile

C1COC(C2=CC=CC=C21)CC(C3CN4CCN3CC4)N

DOS

IR

Vibrations