Geometry & MOs

Info

ID:	225014
PubChem CID:	85735533
Reduced:	ClSO3N4H7C8 (1)
Stoich.:	ABC3D4E7F8 (1)
Weight, g/mol:	284.035255
ΔH_f, kcal/mol:	-36.41
Dipole, Da:	6.11
IP(EA), eV:	-9.42(-2.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-4-(4-nitrophenyl)quinoline

Drug info:

PubChemData

Smile

C1=C2C(=NC(=O)C(=N2)N)C=C(C1S(=O)(=O)N)Cl

DOS

IR

Vibrations