Geometry & MOs

Info

ID:	69446
PubChem CID:	47172430
Reduced:	ClFON2H14C15 (1)
Stoich.:	ABCD2E14F15 (1)
Weight, g/mol:	249.091355
ΔH_f, kcal/mol:	-57.44
Dipole, Da:	3.02
IP(EA), eV:	-9.52(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-fluorophenoxy)-N-(1-methylpyrazol-4-yl)acetamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)CNC(=O)NCC2=CC=C(C=C2)Cl

DOS

IR

Vibrations