Geometry & MOs

Info

ID:	380464
PubChem CID:	134970918
Reduced:	FNO4H18C19 (1)
Stoich.:	ABC4D18E19 (1)
Weight, g/mol:	287.095771
ΔH_f, kcal/mol:	-116.36
Dipole, Da:	2.36
IP(EA), eV:	-9.83(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-6-methyl-3-methylideneoxan-2-one

Drug info:

PubChemData

Smile

CC(=O)C(C(C1=CC(=NO1)C2=CC=CC=C2F)C(=C)C(=O)C)C(=O)C

DOS

IR

Vibrations