Geometry & MOs

Info

ID:	260374
PubChem CID:	103189284
Reduced:	N4O4C13H20 (1)
Stoich.:	A4B4C13D20 (1)
Weight, g/mol:	240.147393
ΔH_f, kcal/mol:	-65.82
Dipole, Da:	8.83
IP(EA), eV:	-9.34(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[1-(dimethylamino)propan-2-yl-ethylamino]furan-2-carboxylic acid

Drug info:

PubChemData

Smile

CCN(C1=C(C=C(C=N1)C(=O)O)[N+](=O)[O-])C(C)CN(C)C

DOS

IR

Vibrations