Geometry & MOs

Info

ID:	213107
PubChem CID:	81062902
Reduced:	FN3O4C13H18 (1)
Stoich.:	AB3C4D13E18 (1)
Weight, g/mol:	287.163377
ΔH_f, kcal/mol:	-117.36
Dipole, Da:	7.36
IP(EA), eV:	-9.32(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethoxyethyl)-N-methyl-2-(methylamino)quinoline-4-carboxamide

Drug info:

PubChemData

Smile

CCOCCN(C)C(=O)C1=CC(=C(C=C1[N+](=O)[O-])F)NC

DOS

IR

Vibrations