Geometry & MOs

Info

ID:	298018
PubChem CID:	117646993
Reduced:	FON4C23H25 (1)
Stoich.:	ABC4D23E25 (1)
Weight, g/mol:	296.096106
ΔH_f, kcal/mol:	-27.52
Dipole, Da:	4.89
IP(EA), eV:	-8.6(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-fluorophenyl)-7-methoxyquinoline-2-carboxamide

Drug info:

PubChemData

Smile

C[C@H]1CNC(CN1CC2=CC3=C(C=C2)C(=CC(=N3)C(=O)N)C4=CC=C(C=C4)F)C

DOS

IR

Vibrations