Geometry & MOs

Info

ID:	70123
PubChem CID:	47207926
Reduced:	NSO4C14H15 (1)
Stoich.:	ABC4D14E15 (1)
Weight, g/mol:	264.074621
ΔH_f, kcal/mol:	-64.18
Dipole, Da:	5.42
IP(EA), eV:	-9.6(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-amino-2-oxoethyl) 4-(2-oxo-1,3-oxazolidin-3-yl)benzoate

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C1=CC=C(C=C1)C=CC(=O)OCC#C

DOS

IR

Vibrations