Geometry & MOs

Info

ID:	344451
PubChem CID:	127267627
Reduced:	N4O4C17H28 (1)
Stoich.:	A4B4C17D28 (1)
Weight, g/mol:	280.153541
ΔH_f, kcal/mol:	-125.69
Dipole, Da:	3.83
IP(EA), eV:	-9.34(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]-(oxolan-3-yl)methanone

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CN2CCN(CC2)C(=O)C(C)OCC3CCCCO3

DOS

IR

Vibrations