Geometry & MOs

Info

ID:	367922
PubChem CID:	127326096
Reduced:	ON5C19H25 (1)
Stoich.:	AB5C19D25 (1)
Weight, g/mol:	311.184506
ΔH_f, kcal/mol:	16.31
Dipole, Da:	5.02
IP(EA), eV:	-8.74(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]methyl]piperidin-3-yl]oxyethanol

Drug info:

PubChemData

Smile

C1CC(C(=O)N(C1)C2=CC=CC=C2)N3CCN(CC3)CC4=NC=CN4

DOS

IR

Vibrations