Geometry & MOs

Info

ID:	228498
PubChem CID:	87564959
Reduced:	ON3H9C12 (1)
Stoich.:	AB3C9D12 (1)
Weight, g/mol:	320.152478
ΔH_f, kcal/mol:	219.88
Dipole, Da:	3.55
IP(EA), eV:	-9.06(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[4-(propan-2-ylamino)phenoxy]quinolin-6-yl]acetaldehyde

Drug info:

PubChemData

Smile

C1C2=C3C=C(C=CC3=NC2=CC=N1)C(=O)N

DOS

IR

Vibrations