Geometry & MOs

Info

ID:	158276
PubChem CID:	56463277
Reduced:	N2S2O6C19H24 (1)
Stoich.:	A2B2C6D19E24 (1)
Weight, g/mol:	428.143964
ΔH_f, kcal/mol:	-201.36
Dipole, Da:	1.58
IP(EA), eV:	-8.75(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-N-(2-ethylsulfonylethyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)CCNC(=O)C1=CC(=CC=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC

DOS

IR

Vibrations