Geometry & MOs

Info

ID:	78227
PubChem CID:	49684186
Reduced:	ClSN2O3C19H25 (1)
Stoich.:	ABC2D3E19F25 (1)
Weight, g/mol:	396.127441
ΔH_f, kcal/mol:	-92.28
Dipole, Da:	5.08
IP(EA), eV:	-8.69(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[[1-[(2,5-dimethylfuran-3-yl)methyl]piperidin-4-yl]methyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(O1)C)CN2CCC(CC2)CNS(=O)(=O)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations