Geometry & MOs

Info

ID:	64185
PubChem CID:	29198004
Reduced:	O2S2N3C19H23 (1)
Stoich.:	A2B2C3D19E23 (1)
Weight, g/mol:	461.07726
ΔH_f, kcal/mol:	-6.5
Dipole, Da:	5.65
IP(EA), eV:	-8.54(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[(2R)-2-(1H-indol-3-yl)-2-piperidin-1-ylethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1CCN(CC1)[C@H](CNS(=O)(=O)C2=CC=CS2)C3=CNC4=CC=CC=C43

DOS

IR

Vibrations