Geometry & MOs

Info

ID:	120686
PubChem CID:	50740057
Reduced:	BrON3H18C22 (1)
Stoich.:	ABC3D18E22 (1)
Weight, g/mol:	359.14339
ΔH_f, kcal/mol:	55.1
Dipole, Da:	5.11
IP(EA), eV:	-8.6(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[(3-fluorophenyl)-(pyridin-2-ylamino)methyl]-2-methylquinolin-8-ol

Drug info:

PubChemData

Smile

CC1=NC2=C(C=C1)C=CC(=C2O)C(C3=CC=CC=C3)NC4=NC=C(C=C4)Br

DOS

IR

Vibrations