Geometry & MOs

Info

ID:	304546
PubChem CID:	124756238
Reduced:	SO3N4C16H24 (1)
Stoich.:	AB3C4D16E24 (1)
Weight, g/mol:	357.18009
ΔH_f, kcal/mol:	-89.74
Dipole, Da:	3.92
IP(EA), eV:	-9.23(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)ethyl]-1-(pyridine-4-carbonyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCC2(C1)CN(CCO2)CC(=O)NC3=NN=C(S3)[C@@H]4CCCO4

DOS

IR

Vibrations