Geometry & MOs

Info

ID:	5655
PubChem CID:	13442
Reduced:	ClSN2O2C10H15 (1)
Stoich.:	ABC2D2E10F15 (1)
Weight, g/mol:	262.054277
ΔH_f, kcal/mol:	-82.66
Dipole, Da:	5.63
IP(EA), eV:	-9.21(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

anilino-(1,1-dioxothiolan-3-yl)azanium;chloride

Drug info:

PubChemData

Smile

C1CS(=O)(=O)CC1[NH2+]NC2=CC=CC=C2.[Cl-]

DOS

IR

Vibrations