Geometry & MOs

Info

ID:	142908
PubChem CID:	53112938
Reduced:	N2O5H18C20 (1)
Stoich.:	A2B5C18D20 (1)
Weight, g/mol:	354.101585
ΔH_f, kcal/mol:	-123.15
Dipole, Da:	3.26
IP(EA), eV:	-8.51(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[2-(4-fluoroanilino)-2-oxoethoxy]quinoline-2-carboxylate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)NC(=O)COC2=CC(=NC3=CC=CC=C32)C(=O)OC

DOS

IR

Vibrations