Geometry & MOs

Info

ID:	60087
PubChem CID:	26675665
Reduced:	NF2O3H15C19 (1)
Stoich.:	AB2C3D15E19 (1)
Weight, g/mol:	315.090686
ΔH_f, kcal/mol:	-125.98
Dipole, Da:	5.63
IP(EA), eV:	-9.46(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-fluoro-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]phenyl]propan-1-one

Drug info:

PubChemData

Smile

CCC(=O)C1=C(C=CC(=C1)F)OCC2=NC=C(O2)C3=CC=C(C=C3)F

DOS

IR

Vibrations