Geometry & MOs

Info

ID:	261425
PubChem CID:	103233337
Reduced:	NOC6H9 (2)
Stoich.:	ABC6D9 (2)
Weight, g/mol:	277.111422
ΔH_f, kcal/mol:	-77.99
Dipole, Da:	2.53
IP(EA), eV:	-8.46(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[2-(2-fluorophenyl)ethylamino]methyl]-5-methylfuran-2-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)NCC(C(=O)O)N

DOS

IR

Vibrations