Geometry & MOs

Info

ID:	346911
PubChem CID:	127271415
Reduced:	O2N5C20H27 (1)
Stoich.:	A2B5C20D27 (1)
Weight, g/mol:	397.247775
ΔH_f, kcal/mol:	-4.41
Dipole, Da:	3.29
IP(EA), eV:	-8.84(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclohexylmethyl)-2-[4-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propanamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)CCN2CCC(CC2)C3=NC(=NO3)C4=CC=CC=N4

DOS

IR

Vibrations