Geometry & MOs

Info

ID:	78231
PubChem CID:	49684191
Reduced:	SF2N2O3C19H24 (1)
Stoich.:	AB2C2D3E19F24 (1)
Weight, g/mol:	398.14757
ΔH_f, kcal/mol:	-179.42
Dipole, Da:	4.39
IP(EA), eV:	-8.58(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-[(2,5-dimethylfuran-3-yl)methyl]piperidin-4-yl]methyl]-2,6-difluorobenzenesulfonamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations