Geometry & MOs

Info

ID:	7144
PubChem CID:	71358
Reduced:	O3N4C17H22 (1)
Stoich.:	A3B4C17D22 (1)
Weight, g/mol:	330.169191
ΔH_f, kcal/mol:	-8.25
Dipole, Da:	5.1
IP(EA), eV:	-8.73(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]oxadiazol-3-ium-5-yl]-4-methoxybenzenecarboximidate

Drug info:

PubChemData

Smile

C[C@@H]1CCC[C@@H](N1[N+]2=NOC(=C2)N=C(C3=CC=C(C=C3)OC)[O-])C

DOS

IR

Vibrations