Geometry & MOs

Info

ID:	388531
PubChem CID:	134989407
Reduced:	NO2C13H15 (1)
Stoich.:	AB2C13D15 (1)
Weight, g/mol:	236.035255
ΔH_f, kcal/mol:	-69.58
Dipole, Da:	5.69
IP(EA), eV:	-9.6(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-3,4-dimethyl-8-nitroquinoline

Drug info:

PubChemData

Smile

C1C[C@H]2[C@@H](C1)OC(=O)N2CC3=CC=CC=C3

DOS

IR

Vibrations