Geometry & MOs

Info

ID:	142210
PubChem CID:	53001354
Reduced:	ClN4O4C24H25 (1)
Stoich.:	AB4C4D24E25 (1)
Weight, g/mol:	434.195405
ΔH_f, kcal/mol:	-80.81
Dipole, Da:	2.65
IP(EA), eV:	-9.01(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[5-[1-[2-(3-methylphenoxy)acetyl]piperidin-4-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Cl)OCC(=O)N2CCC(CC2)C3=NC(=NO3)C4=CC=C(C=C4)NC(=O)C

DOS

IR

Vibrations