Geometry & MOs

Info

ID:	245559
PubChem CID:	99453870
Reduced:	SF3N3O3H14C18 (1)
Stoich.:	AB3C3D3E14F18 (1)
Weight, g/mol:	351.105291
ΔH_f, kcal/mol:	-162.71
Dipole, Da:	2.46
IP(EA), eV:	-9.16(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3R)-1,1-dioxothiolan-3-yl]-N-[2-(2-fluorophenyl)-5-methylpyrazol-3-yl]acetamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)C(F)F)C3=CC=CC=C3F

DOS

IR

Vibrations