Geometry & MOs

Info

ID:	194532
PubChem CID:	78549946
Reduced:	SN2O5C21H30 (1)
Stoich.:	AB2C5D21E30 (1)
Weight, g/mol:	334.262028
ΔH_f, kcal/mol:	-220.56
Dipole, Da:	4.05
IP(EA), eV:	-9.71(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

(1-ethylpyrrolidin-1-ium-2-yl)methyl-[2-hydroxy-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)propyl]azanium

Drug info:

PubChemData

Smile

CC1CCCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)OC(C)C(=O)NC3CCCC3

DOS

IR

Vibrations