Geometry & MOs

Info

ID:	340201
PubChem CID:	127262210
Reduced:	SN3O4C9H9 (1)
Stoich.:	AB3C4D9E9 (1)
Weight, g/mol:	260.046693
ΔH_f, kcal/mol:	-60.42
Dipole, Da:	3.7
IP(EA), eV:	-9.66(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-[amino-(4-methoxyphenoxy)methylidene]amino] methanesulfonate

Drug info:

PubChemData

Smile

CS(=O)(=O)O/N=C(\N)/OC1=CC=C(C=C1)C#N

DOS

IR

Vibrations