Geometry & MOs

Info

ID:	121430
PubChem CID:	50767858
Reduced:	SN3O4C24H35 (1)
Stoich.:	AB3C4D24E35 (1)
Weight, g/mol:	487.194106
ΔH_f, kcal/mol:	-188.82
Dipole, Da:	5.41
IP(EA), eV:	-9.3(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3,3-dimethyl-5-(3-methylpiperidin-1-yl)sulfonyl-2-oxoindol-1-yl]-N-(4-fluoro-2-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3(C)C)CC(=O)NC4CCCCC4

DOS

IR

Vibrations