Geometry & MOs

Info

ID:	264765
PubChem CID:	103489401
Reduced:	FNO4C13H18 (1)
Stoich.:	ABC4D13E18 (1)
Weight, g/mol:	285.137636
ΔH_f, kcal/mol:	-205.87
Dipole, Da:	1.34
IP(EA), eV:	-8.67(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-amino-5-(1-ethoxypropan-2-yloxy)-4-fluorobenzoate

Drug info:

PubChemData

Smile

CCOCC(C)OC1=C(C=C(C(=C1)C(=O)OC)N)F

DOS

IR

Vibrations