Geometry & MOs

Info

ID:	126541
PubChem CID:	50967587
Reduced:	ON6C19H24 (1)
Stoich.:	AB6C19D24 (1)
Weight, g/mol:	364.153541
ΔH_f, kcal/mol:	37.77
Dipole, Da:	9.8
IP(EA), eV:	-8.95(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methyl]pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CN1C=NN=C1CC2CCN(CC2)C(=O)CCN3C=NC4=CC=CC=C43

DOS

IR

Vibrations