Geometry & MOs

Info

ID:	342220
PubChem CID:	127264997
Reduced:	F2N2O3H18C19 (1)
Stoich.:	A2B2C3D18E19 (1)
Weight, g/mol:	349.059564
ΔH_f, kcal/mol:	-166.8
Dipole, Da:	3.47
IP(EA), eV:	-9.65(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-[1-[4-(trifluoromethoxy)phenyl]ethylsulfonylmethyl]-1,2-oxazole

Drug info:

PubChemData

Smile

C1CN(C(CC(=O)N1)C2=CC=CC=C2)C(=O)C3=CC=CC=C3OC(F)F

DOS

IR

Vibrations