Geometry & MOs

Info

ID:	287167
PubChem CID:	104233858
Reduced:	FNO3C11H14 (1)
Stoich.:	ABC3D11E14 (1)
Weight, g/mol:	264.127406
ΔH_f, kcal/mol:	-146.87
Dipole, Da:	4.19
IP(EA), eV:	-9.12(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-(2-fluoro-6-methoxyphenyl)-1,2-oxazol-3-yl]methyl]propan-2-amine

Drug info:

PubChemData

Smile

COC1=C(C(=CC=C1)F)C2(OCCO2)CN

DOS

IR

Vibrations