Geometry & MOs

Info

ID:	402868
PubChem CID:	135057602
Reduced:	NO2F3C13H16 (1)
Stoich.:	AB2C3D13E16 (1)
Weight, g/mol:	201.078979
ΔH_f, kcal/mol:	-234.49
Dipole, Da:	3.46
IP(EA), eV:	-9.11(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(2-methylphenyl)ethynyl]-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C=CC(=C1)C(F)(F)F)CN(C)C

DOS

IR

Vibrations