Geometry & MOs

Info

ID:	202541
PubChem CID:	79683058
Reduced:	ClSO2N6C8H9 (1)
Stoich.:	ABC2D6E8F9 (1)
Weight, g/mol:	242.072513
ΔH_f, kcal/mol:	25.94
Dipole, Da:	1.4
IP(EA), eV:	-9.99(-1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3-dihydroxypropylsulfanyl)-N'-hydroxybenzenecarboximidamide

Drug info:

PubChemData

Smile

C1=NN(C=N1)C2=NC(=NC(=N2)Cl)SCC(CO)O

DOS

IR

Vibrations