Geometry & MOs

Info

ID:	245555
PubChem CID:	99453857
Reduced:	FO2N3C20H20 (1)
Stoich.:	AB2C3D20E20 (1)
Weight, g/mol:	367.105623
ΔH_f, kcal/mol:	-45.95
Dipole, Da:	5.72
IP(EA), eV:	-8.92(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-fluorophenyl)-5-methylpyrazol-3-yl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)O[C@@H](C)C(=O)NC2=CC(=NN2C3=CC=CC=C3F)C

DOS

IR

Vibrations