Geometry & MOs

Info

ID:	123278
PubChem CID:	50840448
Reduced:	SO3N5C21H23 (1)
Stoich.:	AB3C5D21E23 (1)
Weight, g/mol:	369.185255
ΔH_f, kcal/mol:	-29.49
Dipole, Da:	7.16
IP(EA), eV:	-8.29(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-tert-butyl-6-fluoro-3-oxoindazol-1-yl)-N-(4-ethylphenyl)acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2CCN(CC2)C3=NC=C(C(=N3)N)S(=O)(=O)C4=CC=CC=C4

DOS

IR

Vibrations