Geometry & MOs

Info

ID:	183415
PubChem CID:	77021361
Reduced:	SO3N5C12H15 (1)
Stoich.:	AB3C5D12E15 (1)
Weight, g/mol:	247.07391
ΔH_f, kcal/mol:	-20.77
Dipole, Da:	4.06
IP(EA), eV:	-8.91(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-hydroxy-3-[1H-imidazol-5-ylsulfonyl(methyl)amino]propanimidamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(CCC(=NO)N)S(=O)(=O)C2=CN=CN2

DOS

IR

Vibrations