Geometry & MOs

Info

ID:	121421
PubChem CID:	50767630
Reduced:	SN3O5C25H31 (1)
Stoich.:	AB3C5D25E31 (1)
Weight, g/mol:	419.187878
ΔH_f, kcal/mol:	-184.34
Dipole, Da:	4.38
IP(EA), eV:	-8.44(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)-5-piperidin-1-ylsulfonylindol-2-one

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)NC(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)C(C2=O)(C)C

DOS

IR

Vibrations