Geometry & MOs

Info

ID:	122942
PubChem CID:	50827973
Reduced:	O2N5C25H29 (1)
Stoich.:	A2B5C25D29 (1)
Weight, g/mol:	447.22704
ΔH_f, kcal/mol:	28.92
Dipole, Da:	6.54
IP(EA), eV:	-8.4(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3,4-dihydro-2H-quinolin-1-yl)propyl]-3-(4-morpholin-4-ylphenyl)-1,2,4-oxadiazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=CC=C(C=C2)C3=NOC(=N3)C(=O)NCCN4CCC5=CC=CC=C5C4

DOS

IR

Vibrations