Geometry & MOs

Info

ID:	128929
PubChem CID:	51063696
Reduced:	ON4C10H12 (1)
Stoich.:	AB4C10D12 (1)
Weight, g/mol:	301.011741
ΔH_f, kcal/mol:	26.94
Dipole, Da:	5.74
IP(EA), eV:	-8.58(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxybenzaldehyde

Drug info:

PubChemData

Smile

C1COCCN1C2=NC(=C(C=C2)N)C#N

DOS

IR

Vibrations