Geometry & MOs

Info

ID:	180048
PubChem CID:	76570242
Reduced:	ON4C23H26 (1)
Stoich.:	AB4C23D26 (1)
Weight, g/mol:	354.116841
ΔH_f, kcal/mol:	51.42
Dipole, Da:	9.83
IP(EA), eV:	-7.95(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4aH-quinolin-2-ylidene)-6-(4-fluorophenyl)-1H-indol-2-one

Drug info:

PubChemData

Smile

CCN(CC)CCNC1=CC(=C2C3=CC=CC=C3NC2=O)N=C4C1C=CC=C4

DOS

IR

Vibrations