Geometry & MOs

Info

ID:	58511
PubChem CID:	24702186
Reduced:	NO2C15H23 (1)
Stoich.:	AB2C15D23 (1)
Weight, g/mol:	249.051382
ΔH_f, kcal/mol:	-74.44
Dipole, Da:	1.72
IP(EA), eV:	-8.17(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3,4-trifluoroanilino)pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)CN)OCC2CCCCC2

DOS

IR

Vibrations