Geometry & MOs

Info

ID:	250640
PubChem CID:	103098052
Reduced:	OF2N2C16H20 (1)
Stoich.:	AB2C2D16E20 (1)
Weight, g/mol:	258.060469
ΔH_f, kcal/mol:	-133.88
Dipole, Da:	4.8
IP(EA), eV:	-9.38(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,6-difluoropyridin-3-yl)-3-phenylprop-2-ynamide

Drug info:

PubChemData

Smile

C1CCC2CC(CCC2C1)C(=O)NC3=C(N=C(C=C3)F)F

DOS

IR

Vibrations