Geometry & MOs

Info

ID:	155056
PubChem CID:	56320473
Reduced:	FO3N5C24H26 (1)
Stoich.:	AB3C5D24E26 (1)
Weight, g/mol:	436.227454
ΔH_f, kcal/mol:	-78.72
Dipole, Da:	4.64
IP(EA), eV:	-8.86(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-ethylphenyl)ethyl]-2-[3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)NC(=O)CN2CCCC(C2)C3=NC(=NO3)C4=CC(=CC=C4)F)C

DOS

IR

Vibrations