Geometry & MOs

Info

ID:	318584
PubChem CID:	126652114
Reduced:	FON3C22H24 (1)
Stoich.:	ABC3D22E24 (1)
Weight, g/mol:	486.299476
ΔH_f, kcal/mol:	-20.28
Dipole, Da:	3.56
IP(EA), eV:	-8.23(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-8-methyl-3-(4-morpholin-4-ylpiperidin-1-yl)-5-propan-2-yl-6H-indolo[2,3-b]quinolin-11-one

Drug info:

PubChemData

Smile

CC1=C(NC2=C1C=CC(=C2)C#N)N(C3=CC(=C(C=C3)OC(C)C)F)C(C)C

DOS

IR

Vibrations