Geometry & MOs

Info

ID:	261733
PubChem CID:	103248082
Reduced:	NO3C13H19 (1)
Stoich.:	AB3C13D19 (1)
Weight, g/mol:	212.116092
ΔH_f, kcal/mol:	-128.46
Dipole, Da:	4.5
IP(EA), eV:	-9.45(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[1-(3-aminopropylamino)ethyl]furan-2-carboxylic acid

Drug info:

PubChemData

Smile

CCC(C1=CC=CC=C1)NCC(CC(=O)O)O

DOS

IR

Vibrations