Geometry & MOs

Info

ID:	348020
PubChem CID:	127273082
Reduced:	O2N3C13H21 (1)
Stoich.:	A2B3C13D21 (1)
Weight, g/mol:	307.225977
ΔH_f, kcal/mol:	-52.09
Dipole, Da:	3.43
IP(EA), eV:	-9.33(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-cyclohexyloxypiperidin-1-yl)methyl]-5-propan-2-yl-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC(C)C1=NN=C(O1)CN2CCOC3C2CCC3

DOS

IR

Vibrations