Geometry & MOs

Info

ID:	340541
PubChem CID:	127262552
Reduced:	OH2N2C4 (3)
Stoich.:	AB2C2D4 (3)
Weight, g/mol:	156.993056
ΔH_f, kcal/mol:	133.53
Dipole, Da:	2.6
IP(EA), eV:	-8.58(-3.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-[1,3]dioxolo[4,5-b]pyridine

Drug info:

PubChemData

Smile

C1=C/C(=N/C2=C(NC=C(N2)C#N)C#N)/C(=O)C=C1[N+](=O)[O-]

DOS

IR

Vibrations