Geometry & MOs

Info

ID:	419737
PubChem CID:	135108924
Reduced:	SO2N3C19H23 (1)
Stoich.:	AB2C3D19E23 (1)
Weight, g/mol:	340.158706
ΔH_f, kcal/mol:	-28.87
Dipole, Da:	6.8
IP(EA), eV:	-8.62(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-fluorophenyl)azetidin-1-yl]-(2-morpholin-4-ylphenyl)methanone

Drug info:

PubChemData

Smile

CN(C)C(=O)C1=NC(=CC=C1)N2CCC3(CC2)C4=C(CCO3)SC=C4

DOS

IR

Vibrations