Geometry & MOs

Info

ID:	120684
PubChem CID:	50739990
Reduced:	N2O3C10H12 (1)
Stoich.:	A2B3C10D12 (1)
Weight, g/mol:	410.070116
ΔH_f, kcal/mol:	-56.14
Dipole, Da:	2.82
IP(EA), eV:	-9.53(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[[(3,5-dichloropyridin-2-yl)amino]-pyridin-2-ylmethyl]-2-methylquinolin-8-ol

Drug info:

PubChemData

Smile

C1COCCN1C(=O)C2=CC=[N+](C=C2)[O-]

DOS

IR

Vibrations