Geometry & MOs

Info

ID:	50339
PubChem CID:	12012860
Reduced:	BrO2N3H10C18 (1)
Stoich.:	AB2C3D10E18 (1)
Weight, g/mol:	378.99564
ΔH_f, kcal/mol:	101.4
Dipole, Da:	1.75
IP(EA), eV:	-9.68(-2.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-bromoquinolin-3-yl)-8-nitroquinoline

Drug info:

PubChemData

Smile

C1=CC2=C(C=CC(=N2)C3=CN=C4C=CC(=CC4=C3)Br)C(=C1)[N+](=O)[O-]

DOS

IR

Vibrations