Geometry & MOs

Info

ID:	242720
PubChem CID:	99205868
Reduced:	BrNS2O4C16H18 (1)
Stoich.:	ABC2D4E16F18 (1)
Weight, g/mol:	359.143426
ΔH_f, kcal/mol:	-125.19
Dipole, Da:	6.84
IP(EA), eV:	-9.04(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-chlorophenyl)methyl]-4-[[methyl(propan-2-yl)sulfamoyl]amino]piperidine

Drug info:

PubChemData

Smile

CC1=CC=CC=C1[C@H](C)NS(=O)(=O)C2=C(C=CC(=C2)S(=O)(=O)C)Br

DOS

IR

Vibrations