Geometry & MOs

Info

ID:	237852
PubChem CID:	92721959
Reduced:	O3N4C21H30 (1)
Stoich.:	A3B4C21D30 (1)
Weight, g/mol:	459.162806
ΔH_f, kcal/mol:	-64.66
Dipole, Da:	5.66
IP(EA), eV:	-8.63(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(3-fluoro-4-methylphenyl)-1-(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C[C@@H]1C[C@H](CN(C1)CCCNC(=O)CC2=NC(=NO2)C3=CC=C(C=C3)OC)C

DOS

IR

Vibrations