Geometry & MOs

Info

ID:	159459
PubChem CID:	57280240
Reduced:	O3C8H9 (2)
Stoich.:	A3B8C9 (2)
Weight, g/mol:	237.067094
ΔH_f, kcal/mol:	-226.17
Dipole, Da:	4.39
IP(EA), eV:	-11.03(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[methyl-[2-(2-methylprop-2-enoyloxy)ethyl]amino]methanesulfonic acid

Drug info:

PubChemData

Smile

C1CCC(CC1)C23CCC(CC24C(=O)OC4=O)C(=O)OC3=O

DOS

IR

Vibrations