Geometry & MOs

Info

ID:	250585
PubChem CID:	103097686
Reduced:	BrON2F3H6C12 (1)
Stoich.:	ABC2D3E6F12 (1)
Weight, g/mol:	276.107419
ΔH_f, kcal/mol:	-114.52
Dipole, Da:	4.28
IP(EA), eV:	-9.52(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,6-difluoropyridin-3-yl)-3-(4-methylphenyl)propanamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1F)C(=O)NC2=C(N=C(C=C2)F)F)Br

DOS

IR

Vibrations