Geometry & MOs

Info

ID:	365752
PubChem CID:	127318477
Reduced:	N2O3C20H34 (1)
Stoich.:	A2B3C20D34 (1)
Weight, g/mol:	363.252192
ΔH_f, kcal/mol:	-158.96
Dipole, Da:	2.4
IP(EA), eV:	-8.65(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethylpiperazin-1-yl)-2-[1-(7-oxabicyclo[2.2.1]heptane-2-carbonyl)piperidin-4-yl]ethanone

Drug info:

PubChemData

Smile

CC1(CN(CCO1)C2(CCCCC2)CNC(=O)C3CC4CCC3O4)C

DOS

IR

Vibrations