Geometry & MOs

Info

ID:	140207
PubChem CID:	52663017
Reduced:	FSO3N4C22H25 (1)
Stoich.:	ABC3D4E22F25 (1)
Weight, g/mol:	373.099333
ΔH_f, kcal/mol:	-96.98
Dipole, Da:	3.13
IP(EA), eV:	-8.83(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorophenoxy)-N-[4-(3,5-dimethylpyrazol-1-yl)-3-fluorophenyl]acetamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=CC(=C(C=C2)N3C(=CC(=N3)C)C)F

DOS

IR

Vibrations