Geometry & MOs

Info

ID:	31694
PubChem CID:	856495
Reduced:	FN2O2H15C17 (1)
Stoich.:	AB2C2D15E17 (1)
Weight, g/mol:	288.111007
ΔH_f, kcal/mol:	-70.57
Dipole, Da:	3.5
IP(EA), eV:	-8.58(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[[2-(furan-2-ylmethylamino)acetyl]amino]benzoate

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)NC(=O)C(=C2)CNC3=CC=C(C=C3)F

DOS

IR

Vibrations