Geometry & MOs

Info

ID:	318364
PubChem CID:	126650803
Reduced:	SN4O7C24H30 (1)
Stoich.:	AB4C7D24E30 (1)
Weight, g/mol:	282.053789
ΔH_f, kcal/mol:	-130.64
Dipole, Da:	9.0
IP(EA), eV:	-9.09(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;hydroxy-[4-(2-methylpropoxy)phenyl]methanesulfonate

Drug info:

PubChemData

Smile

C[C@@](CCN1CC2=CC(=CN2C1=O)C#CC#CC3(CCN(CC3)C4COC4)O)(C(=O)NO)S(=O)(=O)C

DOS

IR

Vibrations