Geometry & MOs

Info

ID:	351362
PubChem CID:	127280250
Reduced:	ON3C7H10 (2)
Stoich.:	AB3C7D10 (2)
Weight, g/mol:	350.174276
ΔH_f, kcal/mol:	7.86
Dipole, Da:	3.96
IP(EA), eV:	-9.56(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-2-quinolin-8-ylethanone

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CC2CCCN(C2)C(=O)CCN3C=NC=N3

DOS

IR

Vibrations