Geometry & MOs

Info

ID:	251139
PubChem CID:	103101721
Reduced:	N2O2F3C11H11 (1)
Stoich.:	A2B2C3D11E11 (1)
Weight, g/mol:	291.077454
ΔH_f, kcal/mol:	-199.79
Dipole, Da:	2.39
IP(EA), eV:	-10.1(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-2-oxoethyl)-2-chloro-N-ethylquinoline-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(=O)C1=CC(=C(C(=C1)F)F)F

DOS

IR

Vibrations