Geometry & MOs

Info

ID:	31631
PubChem CID:	855957
Reduced:	ClFN4H8C13 (1)
Stoich.:	ABC4D8E13 (1)
Weight, g/mol:	306.136828
ΔH_f, kcal/mol:	76.67
Dipole, Da:	4.83
IP(EA), eV:	-9.96(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-ethoxyphenyl)-3-methylquinoline-4-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=NN=NN2C3=CC=C(C=C3)F)Cl

DOS

IR

Vibrations