Geometry & MOs

Info

ID:	206549
PubChem CID:	80267913
Reduced:	FNO3C11H12 (1)
Stoich.:	ABC3D11E12 (1)
Weight, g/mol:	290.123069
ΔH_f, kcal/mol:	-161.28
Dipole, Da:	7.51
IP(EA), eV:	-9.92(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-difluorophenyl)-2-[methyl-[(6-methylpyridin-2-yl)methyl]amino]ethanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=O)N(C)CC(=O)O)F

DOS

IR

Vibrations