Geometry & MOs

Info

ID:	346290
PubChem CID:	127270794
Reduced:	FSN3O3C17H18 (1)
Stoich.:	ABC3D3E17F18 (1)
Weight, g/mol:	281.106336
ΔH_f, kcal/mol:	-113.27
Dipole, Da:	4.38
IP(EA), eV:	-8.75(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(N(C1)C2=NC=CS2)C(=O)NCC3=CC(=CC4=C3OCOC4)F

DOS

IR

Vibrations