Geometry & MOs

Info

ID:	387788
PubChem CID:	134986933
Reduced:	ION2C9H9 (1)
Stoich.:	ABC2D9E9 (1)
Weight, g/mol:	245.068808
ΔH_f, kcal/mol:	35.28
Dipole, Da:	4.12
IP(EA), eV:	-7.87(-1.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 8-methyl-[1,3]dioxolo[4,5-g]quinoline-7-carboxylate

Drug info:

PubChemData

Smile

C[N+]1=CN=C2C(=C1)C=CC=C2O.[I-]

DOS

IR

Vibrations