Geometry & MOs

Info

ID:	25780
PubChem CID:	630535
Reduced:	FO3C20H27 (1)
Stoich.:	AB3C20D27 (1)
Weight, g/mol:	334.168128
ΔH_f, kcal/mol:	-211.45
Dipole, Da:	4.63
IP(EA), eV:	-9.61(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methoxy-11-(3-methylbutyl)-5-oxidoindolo[3,2-c]quinolin-5-ium

Drug info:

PubChemData

Smile

CC(=O)OC1CCC2C1(CCC3C2CC(=O)C4=C3CCC(C4)F)C

DOS

IR

Vibrations