Geometry & MOs

Info

ID:	179252
PubChem CID:	76456160
Reduced:	ON10H16C17 (1)
Stoich.:	AB10C16D17 (1)
Weight, g/mol:	230.009638
ΔH_f, kcal/mol:	164.87
Dipole, Da:	3.97
IP(EA), eV:	-9.26(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hydroxy-(3,4,5-trihydroxyoxolan-2-yl)methanesulfonic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(C(=O)NC2=CC(=CC(=C2)C3=NNN=N3)C4=NNN=N4)N

DOS

IR

Vibrations