Geometry & MOs

Info

ID:	388741
PubChem CID:	134990060
Reduced:	ClNO3H10C13 (1)
Stoich.:	ABC3D10E13 (1)
Weight, g/mol:	167.118438
ΔH_f, kcal/mol:	-58.28
Dipole, Da:	2.19
IP(EA), eV:	-9.57(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[6-(dimethylamino)pyran-2-ylidene]-dimethylazanium

Drug info:

PubChemData

Smile

CCC1=NOC2=C1C(=O)OC3=C2C=C(C(=C3)C)Cl

DOS

IR

Vibrations