Geometry & MOs

Info

ID:	336842
PubChem CID:	127255849
Reduced:	NO2C12H13 (1)
Stoich.:	AB2C12D13 (1)
Weight, g/mol:	221.068808
ΔH_f, kcal/mol:	-51.47
Dipole, Da:	5.44
IP(EA), eV:	-9.2(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-5-oxo-3-phenyl-1,2-oxazolidine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1CC(=C(N1)C(=O)O)C2=CC=CC=C2

DOS

IR

Vibrations