Geometry & MOs

Info

ID:	162451
PubChem CID:	57394705
Reduced:	FSN2O3C20H23 (1)
Stoich.:	ABC2D3E20F23 (1)
Weight, g/mol:	426.172562
ΔH_f, kcal/mol:	-123.89
Dipole, Da:	5.26
IP(EA), eV:	-9.01(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-methylphenyl)sulfonylamino]-N-pentan-3-yl-1-phenylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)NS(=O)(=O)C)F)C(=O)NCC2=CC=C(C=C2)C3CC3

DOS

IR

Vibrations