Geometry & MOs

Info

ID:	48340
PubChem CID:	10539043
Reduced:	ClON2H9C14 (1)
Stoich.:	ABC2D9E14 (1)
Weight, g/mol:	257.02766
ΔH_f, kcal/mol:	19.13
Dipole, Da:	5.31
IP(EA), eV:	-9.37(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-methylpyrrolidin-1-ium-1-yl)ethanol;iodide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(N=C3C(=C2)C=CC(=O)N3)Cl

DOS

IR

Vibrations