Geometry & MOs

Info

ID:	66126
PubChem CID:	46499884
Reduced:	O3N4H18C19 (1)
Stoich.:	A3B4C18D19 (1)
Weight, g/mol:	311.095771
ΔH_f, kcal/mol:	0.99
Dipole, Da:	5.77
IP(EA), eV:	-8.7(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-4-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]-3-methyl-1,2-oxazol-5-one

Drug info:

PubChemData

Smile

CC\1=NC2=CC=CC=C2/C1=C\NNC(=O)CNC3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations