Geometry & MOs

Info

ID:	25080
PubChem CID:	618776
Reduced:	NO2H5C6 (2)
Stoich.:	AB2C5D6 (2)
Weight, g/mol:	246.064057
ΔH_f, kcal/mol:	-32.0
Dipole, Da:	9.52
IP(EA), eV:	-9.05(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-methyl-6-nitro-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline

Drug info:

PubChemData

Smile

CC1=C2C3=C(C=C(C2=NC=C1)[N+](=O)[O-])OCCO3

DOS

IR

Vibrations