Geometry & MOs

Info

ID:	58882
PubChem CID:	24715032
Reduced:	NO3C17H19 (1)
Stoich.:	AB3C17D19 (1)
Weight, g/mol:	321.137636
ΔH_f, kcal/mol:	-42.03
Dipole, Da:	1.71
IP(EA), eV:	-9.28(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[[(2-fluorophenyl)methyl-(2-methoxyethyl)amino]methyl]furan-2-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(O1)CN(CC2=CC=CC=C2)C3CC3

DOS

IR

Vibrations