Geometry & MOs

Info

ID:	149418
PubChem CID:	53789091
Reduced:	FSN3O3C23H24 (1)
Stoich.:	ABC3D3E23F24 (1)
Weight, g/mol:	260.90953
ΔH_f, kcal/mol:	-103.61
Dipole, Da:	3.77
IP(EA), eV:	-8.74(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-bromothiophen-3-yl)-4-hydroxy-3H-1,3-oxazol-2-one

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCCOC(=O)NC3=CC4=C(C=C3)SC=N4

DOS

IR

Vibrations