Geometry & MOs

Info

ID:	356764
PubChem CID:	127292304
Reduced:	SO3N5C18H29 (1)
Stoich.:	AB3C5D18E29 (1)
Weight, g/mol:	374.175419
ΔH_f, kcal/mol:	-99.37
Dipole, Da:	2.78
IP(EA), eV:	-8.44(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethyl]-2-(1H-imidazol-2-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C2CCN(C2)C(=O)NCC3=CC(=CC=C3)S(=O)(=O)N

DOS

IR

Vibrations