Geometry & MOs

Info

ID:	362648
PubChem CID:	127308926
Reduced:	ON5C17H27 (1)
Stoich.:	AB5C17D27 (1)
Weight, g/mol:	393.115855
ΔH_f, kcal/mol:	-6.69
Dipole, Da:	9.72
IP(EA), eV:	-9.51(0.32)
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-(1,3-thiazol-2-yl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CCC1CCCCC1NC(=O)N2CCN3C(=NN=C3C4CC4)C2

DOS

IR

Vibrations