Geometry & MOs

Info

ID:	44047
PubChem CID:	10500610
Reduced:	N2O2C10H15 (2)
Stoich.:	A2B2C10D15 (2)
Weight, g/mol:	279.095595
ΔH_f, kcal/mol:	-175.11
Dipole, Da:	4.08
IP(EA), eV:	-9.27(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

5,12-dimethylquinolino[3,4-b][1,4]benzothiazin-5-ium

Drug info:

PubChemData

Smile

CC(=O)CCCCCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCC(=O)C

DOS

IR

Vibrations