Geometry & MOs

Info

ID:	205359
PubChem CID:	80091686
Reduced:	NOC7H7 (2)
Stoich.:	ABC7D7 (2)
Weight, g/mol:	232.084792
ΔH_f, kcal/mol:	-46.06
Dipole, Da:	4.93
IP(EA), eV:	-8.67(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2,6-dimethylpyridin-3-yl)amino]furan-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1=NC(=C(C=C1)NC2=CC=CC=C2C(=O)O)C

DOS

IR

Vibrations