Geometry & MOs

Info

ID:	78265
PubChem CID:	49684236
Reduced:	FSN2O4C21H29 (1)
Stoich.:	ABC2D4E21F29 (1)
Weight, g/mol:	426.138006
ΔH_f, kcal/mol:	-183.3
Dipole, Da:	6.17
IP(EA), eV:	-8.59(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)S(=O)(=O)NCC2CCN(CC2)CC3=C(OC(=C3)C)C)F

DOS

IR

Vibrations