Geometry & MOs

Info

ID:	24800
PubChem CID:	613710
Reduced:	ClN2O2H7C10 (1)
Stoich.:	AB2C2D7E10 (1)
Weight, g/mol:	222.019605
ΔH_f, kcal/mol:	33.73
Dipole, Da:	0.81
IP(EA), eV:	-10.01(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-methyl-5-nitroquinoline

Drug info:

PubChemData

Smile

CC1=CC(=NC2=C1C(=CC=C2)[N+](=O)[O-])Cl

DOS

IR

Vibrations