Geometry & MOs

Info

ID:	368602
PubChem CID:	127329622
Reduced:	NOC13H25 (1)
Stoich.:	ABC13D25 (1)
Weight, g/mol:	371.224263
ΔH_f, kcal/mol:	-76.74
Dipole, Da:	2.98
IP(EA), eV:	-8.62(2.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(1,1-dioxothiolan-3-yl)piperazin-1-yl]-2-(2-propan-2-ylpiperidin-1-yl)ethanone

Drug info:

PubChemData

Smile

CC(C)C1CCCCN1CC2CCOC2

DOS

IR

Vibrations