Geometry & MOs

Info

ID:	37913
PubChem CID:	8025524
Reduced:	OCl2N4H12C15 (1)
Stoich.:	AB2C4D12E15 (1)
Weight, g/mol:	311.179324
ΔH_f, kcal/mol:	42.06
Dipole, Da:	2.48
IP(EA), eV:	-9.52(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-2,4,6-trimethylbenzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=NN2CC(=O)NCC3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations