Geometry & MOs

Info

ID:	27312
PubChem CID:	820501
Reduced:	Cl2N4H6C11 (1)
Stoich.:	A2B4C6D11 (1)
Weight, g/mol:	284.035255
ΔH_f, kcal/mol:	113.35
Dipole, Da:	6.43
IP(EA), eV:	-9.3(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(5-chloropyridin-2-yl)amino]methylidene]indene-1,3-dione

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Cl)Cl)C=NC(=C(C#N)N)C#N

DOS

IR

Vibrations