Geometry & MOs

Info

ID:	49989
PubChem CID:	11538615
Reduced:	NO3S3C18H27 (1)
Stoich.:	AB3C3D18E27 (1)
Weight, g/mol:	401.824758
ΔH_f, kcal/mol:	-137.7
Dipole, Da:	9.04
IP(EA), eV:	-9.2(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pentasodium;hydrogen peroxide;[oxido(phosphonatooxy)phosphoryl] phosphate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2[C@H](CC3(CC2O)SCCS3)CC(C)C

DOS

IR

Vibrations