Geometry & MOs

Info

ID:	145428
PubChem CID:	53523599
Reduced:	NO2H8C9 (2)
Stoich.:	AB2C8D9 (2)
Weight, g/mol:	242.145285
ΔH_f, kcal/mol:	-100.2
Dipole, Da:	3.64
IP(EA), eV:	-8.83(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-piperidin-1-yl-2-thiomorpholin-4-ylpropan-1-one

Drug info:

PubChemData

Smile

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=CC4=C(C=C3)NC(=O)C4

DOS

IR

Vibrations