Geometry & MOs

Info

ID:	261432
PubChem CID:	103233784
Reduced:	NCl2O3C14H19 (1)
Stoich.:	AB2C3D14E19 (1)
Weight, g/mol:	288.111007
ΔH_f, kcal/mol:	-136.01
Dipole, Da:	2.7
IP(EA), eV:	-9.22(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3-acetamidoanilino)methyl]-3-methylfuran-2-carboxylic acid

Drug info:

PubChemData

Smile

CCOC(=O)COCCNCCC1=C(C=C(C=C1)Cl)Cl

DOS

IR

Vibrations