Geometry & MOs

Info

ID:	365746
PubChem CID:	127318471
Reduced:	N3O3C16H21 (1)
Stoich.:	A3B3C16D21 (1)
Weight, g/mol:	305.173942
ΔH_f, kcal/mol:	-85.98
Dipole, Da:	4.64
IP(EA), eV:	-8.21(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-(7-oxabicyclo[2.2.1]heptan-2-yl)methanone

Drug info:

PubChemData

Smile

C1CC2C(CC1O2)C(=O)NC3=NC=C(C=C3)N4CCOCC4

DOS

IR

Vibrations