Geometry & MOs

Info

ID:	398639
PubChem CID:	135034498
Reduced:	NOH21C30 (1)
Stoich.:	ABC21D30 (1)
Weight, g/mol:	341.121592
ΔH_f, kcal/mol:	85.16
Dipole, Da:	3.86
IP(EA), eV:	-9.08(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-fluorophenyl)-2-(2-phenylquinolin-4-yl)ethanone

Drug info:

PubChemData

Smile

C1C2=CC=CC=C2C3=C1C=C(C=C3)C(=O)CC4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6

DOS

IR

Vibrations