Geometry & MOs

Info

ID:	293136
PubChem CID:	117374733
Reduced:	BrClFNH4C8 (1)
Stoich.:	ABCDE4F8 (1)
Weight, g/mol:	247.996425
ΔH_f, kcal/mol:	1.04
Dipole, Da:	3.41
IP(EA), eV:	-10.06(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-chloro-2,5,6-trifluorophenyl)-1,2-oxazol-3-amine

Drug info:

PubChemData

Smile

C1=C(C=C(C(=C1F)Br)Cl)CC#N

DOS

IR

Vibrations