Geometry & MOs

Info

ID:	216958
PubChem CID:	85087034
Reduced:	SN3O6C11H17 (1)
Stoich.:	AB3C6D11E17 (1)
Weight, g/mol:	319.083806
ΔH_f, kcal/mol:	-198.44
Dipole, Da:	8.42
IP(EA), eV:	-8.32(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diaminomethylidene(dimethyl)azanium;2-(3,4-dihydroxyphenyl)ethenyl sulfate

Drug info:

PubChemData

Smile

CN(C)C(=N)N.C1=CC(=C(C=C1C=COS(=O)(=O)O)O)O

DOS

IR

Vibrations