Geometry & MOs

Info

ID:	202542
PubChem CID:	79683151
Reduced:	SN2O3C10H14 (1)
Stoich.:	AB2C3D10E14 (1)
Weight, g/mol:	228.068097
ΔH_f, kcal/mol:	-70.4
Dipole, Da:	3.31
IP(EA), eV:	-8.95(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2,3-dihydroxypropylsulfanyl)pyrazine-2-carboximidamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=NO)N)SCC(CO)O

DOS

IR

Vibrations