Geometry & MOs

Info

ID:	387664
PubChem CID:	134986353
Reduced:	NPO6C11H22 (1)
Stoich.:	ABC6D11E22 (1)
Weight, g/mol:	239.071794
ΔH_f, kcal/mol:	-313.62
Dipole, Da:	2.91
IP(EA), eV:	-9.14(0.77)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(E)-1,3-dichloro-3-(dimethylamino)-2-ethoxyprop-2-enylidene]-dimethylazanium

Drug info:

PubChemData

Smile

CCOP(=O)(C[C@@H]1C[C@H](ON1C)OC(=O)C)OCC

DOS

IR

Vibrations