Geometry & MOs

Info

ID:	21784
PubChem CID:	589910
Reduced:	ClNO3H16C17 (1)
Stoich.:	ABC3D16E17 (1)
Weight, g/mol:	317.081871
ΔH_f, kcal/mol:	-87.5
Dipole, Da:	3.68
IP(EA), eV:	-8.83(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-chlorophenoxy)methyl]-3-(4-methylphenyl)-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2CC(OC2=O)COC3=CC=C(C=C3)Cl

DOS

IR

Vibrations