Geometry & MOs

Info

ID:	78311
PubChem CID:	49684398
Reduced:	SN4O4C17H20 (1)
Stoich.:	AB4C4D17E20 (1)
Weight, g/mol:	379.136591
ΔH_f, kcal/mol:	-27.58
Dipole, Da:	3.71
IP(EA), eV:	-8.61(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-2-methoxy-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1CN(CCC1CNS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C3=CC=CC=N3

DOS

IR

Vibrations