Geometry & MOs

Info

ID:	373794
PubChem CID:	131320118
Reduced:	ON4H6C10 (1)
Stoich.:	AB4C6D10 (1)
Weight, g/mol:	317.90185
ΔH_f, kcal/mol:	92.6
Dipole, Da:	4.68
IP(EA), eV:	-10.0(-1.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-6-chloro-3-(trifluoromethoxy)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)N2C=NC=N2)C(=O)C#N

DOS

IR

Vibrations