Geometry & MOs

Info

ID:	8526
PubChem CID:	78883
Reduced:	SN2O4C12H24 (1)
Stoich.:	AB2C4D12E24 (1)
Weight, g/mol:	292.145678
ΔH_f, kcal/mol:	-163.97
Dipole, Da:	13.9
IP(EA), eV:	-9.46(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[dimethyl-[3-(2-methylprop-2-enoylamino)propyl]azaniumyl]propane-1-sulfonate

Drug info:

PubChemData

Smile

CC(=C)C(=O)NCCC[N+](C)(C)CCCS(=O)(=O)[O-]

DOS

IR

Vibrations