Geometry & MOs

Info

ID:	343969
PubChem CID:	127267145
Reduced:	FSN3O5C13H16 (1)
Stoich.:	ABC3D5E13F16 (1)
Weight, g/mol:	342.079804
ΔH_f, kcal/mol:	-142.43
Dipole, Da:	5.34
IP(EA), eV:	-9.62(-2.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-5-methyl-4-nitro-N-(1-propan-2-ylpyrazol-3-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1[N+](=O)[O-])F)S(=O)(=O)NNC(=O)C2CCCC2

DOS

IR

Vibrations