Geometry & MOs

Info

ID:	371077
PubChem CID:	127342305
Reduced:	FN3O4C16H20 (1)
Stoich.:	AB3C4D16E20 (1)
Weight, g/mol:	374.175419
ΔH_f, kcal/mol:	-199.43
Dipole, Da:	7.48
IP(EA), eV:	-9.27(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-4-(pyrazol-1-ylmethyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CN1CC(CCC1=O)NC(=O)NCC2=CC(=CC3=C2OCOC3)F

DOS

IR

Vibrations