Geometry & MOs

Info

ID:	364586
PubChem CID:	127315838
Reduced:	N3O3C19H33 (1)
Stoich.:	A3B3C19D33 (1)
Weight, g/mol:	373.203528
ΔH_f, kcal/mol:	-147.49
Dipole, Da:	8.64
IP(EA), eV:	-8.69(1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(1,1-dioxothiolan-3-yl)piperazin-1-yl]-2-[3-(methoxymethyl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

COCC1CCCN(C1)CC(=O)N2CCC(CC2)C(=O)N3CCCC3

DOS

IR

Vibrations