Geometry & MOs

Info

ID:	38026
PubChem CID:	8026482
Reduced:	ClNO4H16C19 (1)
Stoich.:	ABC4D16E19 (1)
Weight, g/mol:	357.076786
ΔH_f, kcal/mol:	-115.42
Dipole, Da:	8.97
IP(EA), eV:	-9.52(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R)-1-(2-chlorophenyl)ethyl] 2-anilino-4-oxofuran-3-carboxylate

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1Cl)OC(=O)C2=C(OCC2=O)NC3=CC=CC=C3

DOS

IR

Vibrations