Geometry & MOs

Info

ID:	15783
PubChem CID:	450505
Reduced:	ISN3O4C8H12 (1)
Stoich.:	ABC3D4E8F12 (1)
Weight, g/mol:	376.960978
ΔH_f, kcal/mol:	-120.56
Dipole, Da:	7.25
IP(EA), eV:	-9.56(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-(131I)iodanylphenyl)methyl]guanidine;sulfuric acid

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)[131I])CN=C(N)N.OS(=O)(=O)O

DOS

IR

Vibrations