Geometry & MOs

Info

ID:	192595
PubChem CID:	78288703
Reduced:	NSCl2O5H19C21 (1)
Stoich.:	ABC2D5E19F21 (1)
Weight, g/mol:	295.100857
ΔH_f, kcal/mol:	-151.19
Dipole, Da:	6.05
IP(EA), eV:	-9.39(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-ethylphenyl)methylidene]-2-(4-fluorophenyl)-1,3-oxazol-5-one

Drug info:

PubChemData

Smile

C=CCN(C1=CC=C(C=C1)Cl)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OC3CCCC3=O

DOS

IR

Vibrations