Geometry & MOs

Info

ID:	25110
PubChem CID:	618989
Reduced:	NO4C13H13 (1)
Stoich.:	AB4C13D13 (1)
Weight, g/mol:	247.084458
ΔH_f, kcal/mol:	-126.41
Dipole, Da:	3.67
IP(EA), eV:	-9.2(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-anilino-5-oxo-2H-furan-3-carboxylate

Drug info:

PubChemData

Smile

COC1=C(C(=NC2=CC=CC=C21)OC)CC(=O)O

DOS

IR

Vibrations