Geometry & MOs

Info

ID:	287169
PubChem CID:	104233868
Reduced:	FN2O3C14H17 (1)
Stoich.:	AB2C3D14E17 (1)
Weight, g/mol:	284.98007
ΔH_f, kcal/mol:	-81.03
Dipole, Da:	2.85
IP(EA), eV:	-9.34(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(bromomethyl)-5-(2-fluoro-6-methoxyphenyl)-1,2-oxazole

Drug info:

PubChemData

Smile

COCCNCC1=NOC(=C1)C2=C(C=CC=C2F)OC

DOS

IR

Vibrations