Geometry & MOs

Info

ID:	354093
PubChem CID:	127285897
Reduced:	ON3C13H23 (1)
Stoich.:	AB3C13D23 (1)
Weight, g/mol:	377.279075
ΔH_f, kcal/mol:	-27.84
Dipole, Da:	5.13
IP(EA), eV:	-8.78(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[4-[2-(2,5-dimethylpyrrolidin-1-yl)ethyl]piperazin-1-yl]methyl]-5-(oxan-4-yl)-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CN1CCC(C1)C(=O)N2CCN(CC2)C3CC3

DOS

IR

Vibrations