Geometry & MOs

Info

ID:	371412
PubChem CID:	127346285
Reduced:	NSO2C10H17 (1)
Stoich.:	ABC2D10E17 (1)
Weight, g/mol:	270.157957
ΔH_f, kcal/mol:	-98.74
Dipole, Da:	4.6
IP(EA), eV:	-8.9(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2-methoxyacetyl)piperazin-1-yl]-2-(oxolan-3-yl)ethanone

Drug info:

PubChemData

Smile

C1COCC1CC(=O)N2CCSCC2

DOS

IR

Vibrations